Phenylpropanes

Organic compound that contain a propane chain with a phenyl substitution in the following structure: C₆H₅CH₂CH2CH3. These compounds are considered hydrocarbons.

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2,6-Di-tert-butylphenol, 99%

CAS: 128-39-2 Molecular Formula: C14H22O Molecular Weight (g/mol): 206.33 MDL Number: MFCD00008820 InChI Key: DKCPKDPYUFEZCP-UHFFFAOYSA-N Synonym: 2,6-di-tert-butylphenol,2,6-di-t-butylphenol,2,6-bis tert-butyl phenol,2,6-bis 1,1-dimethylethyl phenol,phenol, 2,6-bis 1,1-dimethylethyl,2,6 di-tert-butylphenol,ethanox 701,isonox 103,ethyl 701,ethyl an 701 PubChem CID: 31405 IUPAC Name: 2,6-ditert-butylphenol SMILES: CC(C)(C)C1=CC=CC(=C1O)C(C)(C)C

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PubChem CID	31405
CAS	128-39-2
Molecular Weight (g/mol)	206.33
MDL Number	MFCD00008820
SMILES	CC(C)(C)C1=CC=CC(=C1O)C(C)(C)C
Synonym	2,6-di-tert-butylphenol,2,6-di-t-butylphenol,2,6-bis tert-butyl phenol,2,6-bis 1,1-dimethylethyl phenol,phenol, 2,6-bis 1,1-dimethylethyl,2,6 di-tert-butylphenol,ethanox 701,isonox 103,ethyl 701,ethyl an 701
IUPAC Name	2,6-ditert-butylphenol
InChI Key	DKCPKDPYUFEZCP-UHFFFAOYSA-N
Molecular Formula	C14H22O

Butylated Hydroxytoluene, 99.5%, MP Biomedicals™

CAS: 128-37-0 Molecular Formula: C15H24O Molecular Weight (g/mol): 220.356 InChI Key: NLZUEZXRPGMBCV-UHFFFAOYSA-N Synonym: 2,6-di-tert-butyl-4-methylphenol,butylated hydroxytoluene,butylhydroxytoluene,2,6-di-tert-butyl-p-cresol,2,6-di-t-butyl-4-methylphenol,ionol,dbpc,dibunol,stavox,bht PubChem CID: 31404 ChEBI: CHEBI:34247 IUPAC Name: 2,6-ditert-butyl-4-methylphenol SMILES: CC1=CC(=C(C(=C1)C(C)(C)C)O)C(C)(C)C

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PubChem CID	31404
CAS	128-37-0
Molecular Weight (g/mol)	220.356
ChEBI	CHEBI:34247
SMILES	CC1=CC(=C(C(=C1)C(C)(C)C)O)C(C)(C)C
Synonym	2,6-di-tert-butyl-4-methylphenol,butylated hydroxytoluene,butylhydroxytoluene,2,6-di-tert-butyl-p-cresol,2,6-di-t-butyl-4-methylphenol,ionol,dbpc,dibunol,stavox,bht
IUPAC Name	2,6-ditert-butyl-4-methylphenol
InChI Key	NLZUEZXRPGMBCV-UHFFFAOYSA-N
Molecular Formula	C15H24O

Butylated Hydroxytoluene Crystalline MP Biomedicals

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PubChem CID	31404
CAS	128-37-0
Molecular Weight (g/mol)	220.356
ChEBI	CHEBI:34247
SMILES	CC1=CC(=C(C(=C1)C(C)(C)C)O)C(C)(C)C
Synonym	2,6-di-tert-butyl-4-methylphenol,butylated hydroxytoluene,butylhydroxytoluene,2,6-di-tert-butyl-p-cresol,2,6-di-t-butyl-4-methylphenol,ionol,dbpc,dibunol,stavox,bht
IUPAC Name	2,6-ditert-butyl-4-methylphenol
InChI Key	NLZUEZXRPGMBCV-UHFFFAOYSA-N
Molecular Formula	C15H24O

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4-tert-Butylcatechol, 98%

CAS: 98-29-3 Molecular Formula: C10H14O2 Molecular Weight (g/mol): 166.22 MDL Number: MFCD00002201 InChI Key: XESZUVZBAMCAEJ-UHFFFAOYSA-N Synonym: 4-tert-butylcatechol,p-tert-butylcatechol,4-tert-butylpyrocatechol,p-tert-butyl catechol,4-tert-butyl benzene-1,2-diol,4-t-butylpyrocatechol,p-tert-butylpyrocatechol,4-t-butylcatechol,1,2-benzenediol, 4-1,1-dimethylethyl,4-tert-butylcatechin PubChem CID: 7381 IUPAC Name: 4-tert-butylbenzene-1,2-diol SMILES: CC(C)(C)C1=CC=C(O)C(O)=C1

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PubChem CID	7381
CAS	98-29-3
Molecular Weight (g/mol)	166.22
MDL Number	MFCD00002201
SMILES	CC(C)(C)C1=CC=C(O)C(O)=C1
Synonym	4-tert-butylcatechol,p-tert-butylcatechol,4-tert-butylpyrocatechol,p-tert-butyl catechol,4-tert-butyl benzene-1,2-diol,4-t-butylpyrocatechol,p-tert-butylpyrocatechol,4-t-butylcatechol,1,2-benzenediol, 4-1,1-dimethylethyl,4-tert-butylcatechin
IUPAC Name	4-tert-butylbenzene-1,2-diol
InChI Key	XESZUVZBAMCAEJ-UHFFFAOYSA-N
Molecular Formula	C10H14O2

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2,6-Di-tert-butyl-4-methylphenol, 99.8%

CAS: 128-37-0 Molecular Formula: C₁₅H₂₄O Molecular Weight (g/mol): 220.35 MDL Number: MFCD00011644 InChI Key: NLZUEZXRPGMBCV-UHFFFAOYSA-N Synonym: 2,6-di-tert-butyl-4-methylphenol,butylated hydroxytoluene,butylhydroxytoluene,2,6-di-tert-butyl-p-cresol,2,6-di-t-butyl-4-methylphenol,ionol,dbpc,dibunol,stavox,bht PubChem CID: 31404 ChEBI: CHEBI:34247 IUPAC Name: 2,6-ditert-butyl-4-methylphenol SMILES: CC1=CC(=C(C(=C1)C(C)(C)C)O)C(C)(C)C

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PubChem CID	31404
CAS	128-37-0
Molecular Weight (g/mol)	220.35
ChEBI	CHEBI:34247
MDL Number	MFCD00011644
SMILES	CC1=CC(=C(C(=C1)C(C)(C)C)O)C(C)(C)C
Synonym	2,6-di-tert-butyl-4-methylphenol,butylated hydroxytoluene,butylhydroxytoluene,2,6-di-tert-butyl-p-cresol,2,6-di-t-butyl-4-methylphenol,ionol,dbpc,dibunol,stavox,bht
IUPAC Name	2,6-ditert-butyl-4-methylphenol
InChI Key	NLZUEZXRPGMBCV-UHFFFAOYSA-N
Molecular Formula	C₁₅H₂₄O

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tert-Butylhydroquinone, 97%

CAS: 1948-33-0 Molecular Formula: C₁₀H₁₄O₂ Molecular Weight (g/mol): 166.22 MDL Number: MFCD00002344 InChI Key: BGNXCDMCOKJUMV-UHFFFAOYSA-N Synonym: tert-butylhydroquinone,tbhq,2-tert-butylhydroquinone,t-butylhydroquinone,mtbhq,t-butyl hydroquinone,2-tert-butyl-1,4-benzenediol,2-t-butylhydroquinone,mono-tert-butylhydroquinone,sustane PubChem CID: 16043 ChEBI: CHEBI:78886 IUPAC Name: 2-tert-butylbenzene-1,4-diol SMILES: CC(C)(C)C1=C(C=CC(=C1)O)O

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PubChem CID	16043
CAS	1948-33-0
Molecular Weight (g/mol)	166.22
ChEBI	CHEBI:78886
MDL Number	MFCD00002344
SMILES	CC(C)(C)C1=C(C=CC(=C1)O)O
Synonym	tert-butylhydroquinone,tbhq,2-tert-butylhydroquinone,t-butylhydroquinone,mtbhq,t-butyl hydroquinone,2-tert-butyl-1,4-benzenediol,2-t-butylhydroquinone,mono-tert-butylhydroquinone,sustane
IUPAC Name	2-tert-butylbenzene-1,4-diol
InChI Key	BGNXCDMCOKJUMV-UHFFFAOYSA-N
Molecular Formula	C₁₀H₁₄O₂

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4-tert-Butylphenylmagnesium bromide, 0.50 M in 2-MeTHF

CAS: 63488-10-8 Molecular Formula: C10H13BrMg Molecular Weight (g/mol): 237.42 MDL Number: MFCD00013244 InChI Key: YECFWFOEQLAVNH-UHFFFAOYSA-M Synonym: 4-tert-butylphenylmagnesium bromide,4-t-butylphenylmagnesium bromide,bromo 4-tert-butylphenyl magnesium,magnesium, bromo 4-1,1-dimethylethyl phenyl,4-tert-butylphenylmagnesium bromide solution,yecfwfoeqlavnh-uhfffaoysa-m,4-tert-butylphenyhnagnesium bromide,4-tert.-butylphenylmagnesium bromide,4-tert-butylphenyl magnesium bromide,4-tert butyl phenyl magnesium bromide,grignard reagent PubChem CID: 4608371 IUPAC Name: magnesium;tert-butylbenzene;bromide SMILES: CC(C)(C)C1=CC=C([Mg]Br)C=C1

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PubChem CID	4608371
CAS	63488-10-8
Molecular Weight (g/mol)	237.42
MDL Number	MFCD00013244
SMILES	CC(C)(C)C1=CC=C([Mg]Br)C=C1
Synonym	4-tert-butylphenylmagnesium bromide,4-t-butylphenylmagnesium bromide,bromo 4-tert-butylphenyl magnesium,magnesium, bromo 4-1,1-dimethylethyl phenyl,4-tert-butylphenylmagnesium bromide solution,yecfwfoeqlavnh-uhfffaoysa-m,4-tert-butylphenyhnagnesium bromide,4-tert.-butylphenylmagnesium bromide,4-tert-butylphenyl magnesium bromide,4-tert butyl phenyl magnesium bromide,grignard reagent
IUPAC Name	magnesium;tert-butylbenzene;bromide
InChI Key	YECFWFOEQLAVNH-UHFFFAOYSA-M
Molecular Formula	C10H13BrMg

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1-tert-Butyl-4-iodobenzene, 97%

CAS: 35779-04-5 Molecular Formula: C10H13I Molecular Weight (g/mol): 260.118 MDL Number: MFCD00052339 InChI Key: WQVIVQDHNKQWTM-UHFFFAOYSA-N Synonym: 1-tert-butyl-4-iodobenzene,4-tert-butyliodobenzene,4-t-butyliodobenzene,1-iodo-4-tert-butylbenzene,benzene, 1-1,1-dimethylethyl-4-iodo,4-tert-butyl-1-iodobenzene,2-4-iodophenyl-2-methylpropane,2-4'-iodophenyl-2-methylpropane,pubchem3974,4-t-butyl-iodobenzene PubChem CID: 142029 IUPAC Name: 1-tert-butyl-4-iodobenzene SMILES: CC(C)(C)C1=CC=C(C=C1)I

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PubChem CID	142029
CAS	35779-04-5
Molecular Weight (g/mol)	260.118
MDL Number	MFCD00052339
SMILES	CC(C)(C)C1=CC=C(C=C1)I
Synonym	1-tert-butyl-4-iodobenzene,4-tert-butyliodobenzene,4-t-butyliodobenzene,1-iodo-4-tert-butylbenzene,benzene, 1-1,1-dimethylethyl-4-iodo,4-tert-butyl-1-iodobenzene,2-4-iodophenyl-2-methylpropane,2-4'-iodophenyl-2-methylpropane,pubchem3974,4-t-butyl-iodobenzene
IUPAC Name	1-tert-butyl-4-iodobenzene
InChI Key	WQVIVQDHNKQWTM-UHFFFAOYSA-N
Molecular Formula	C10H13I

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4-tert-Amylphenol, 99%

CAS: 80-46-6 Molecular Formula: C₁₁H₁₆O Molecular Weight (g/mol): 164.25 MDL Number: MFCD00002369 InChI Key: NRZWYNLTFLDQQX-UHFFFAOYSA-N Synonym: 4-tert-amylphenol,4-tert-pentylphenol,p-tert-amylphenol,p-tert-pentylphenol,4-t-amylphenol,4-1,1-dimethylpropyl phenol,amilphenol,amilfenol,pentaphen,tert-amylphenol PubChem CID: 6643 ChEBI: CHEBI:35096 IUPAC Name: 4-(2-methylbutan-2-yl)phenol SMILES: CCC(C)(C)C1=CC=C(C=C1)O

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PubChem CID	6643
CAS	80-46-6
Molecular Weight (g/mol)	164.25
ChEBI	CHEBI:35096
MDL Number	MFCD00002369
SMILES	CCC(C)(C)C1=CC=C(C=C1)O
Synonym	4-tert-amylphenol,4-tert-pentylphenol,p-tert-amylphenol,p-tert-pentylphenol,4-t-amylphenol,4-1,1-dimethylpropyl phenol,amilphenol,amilfenol,pentaphen,tert-amylphenol
IUPAC Name	4-(2-methylbutan-2-yl)phenol
InChI Key	NRZWYNLTFLDQQX-UHFFFAOYSA-N
Molecular Formula	C₁₁H₁₆O

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4-tert-Butylbenzoic acid, 99%

CAS: 98-73-7 Molecular Formula: C11H14O2 Molecular Weight (g/mol): 178.23 MDL Number: MFCD00002563 InChI Key: KDVYCTOWXSLNNI-UHFFFAOYSA-N Synonym: 4-tert-butyl benzoic acid,tbba,p-tert-butylbenzoic acid,benzoic acid, 4-1,1-dimethylethyl,4-t-butylbenzoic acid,benzoic acid, p-tert-butyl,4-tert-butyl-benzoic acid,p-t-butylbenzoic acid,4-tert-butylbenzoicacid,unii-43z7t3vn0r PubChem CID: 7403 ChEBI: CHEBI:34443 IUPAC Name: 4-tert-butylbenzoic acid SMILES: CC(C)(C)C1=CC=C(C=C1)C(O)=O

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PubChem CID	7403
CAS	98-73-7
Molecular Weight (g/mol)	178.23
ChEBI	CHEBI:34443
MDL Number	MFCD00002563
SMILES	CC(C)(C)C1=CC=C(C=C1)C(O)=O
Synonym	4-tert-butyl benzoic acid,tbba,p-tert-butylbenzoic acid,benzoic acid, 4-1,1-dimethylethyl,4-t-butylbenzoic acid,benzoic acid, p-tert-butyl,4-tert-butyl-benzoic acid,p-t-butylbenzoic acid,4-tert-butylbenzoicacid,unii-43z7t3vn0r
IUPAC Name	4-tert-butylbenzoic acid
InChI Key	KDVYCTOWXSLNNI-UHFFFAOYSA-N
Molecular Formula	C11H14O2

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(R)-(-)-2-Phenylbutyric acid, 99%

CAS: 938-79-4 Molecular Formula: C10H12O2 Molecular Weight (g/mol): 164.20 MDL Number: MFCD00063165 InChI Key: OFJWFSNDPCAWDK-UHFFFAOYNA-N Synonym: r---2-phenylbutyric acid,2r-2-phenylbutanoic acid,2-phenylbutyric acid, r,r-2-phenylbutyric acid,benzeneacetic acid, alpha-ethyl-, r,r-2-phenylbutanoic acid,2r-2-phenyl-butanoic acid,2r-2-phenyl-mutanoic acid,r---2-phenylbutanoic acid,benzeneacetic acid,a-ethyl-, ar PubChem CID: 785330 IUPAC Name: (2R)-2-phenylbutanoic acid SMILES: CCC(C(O)=O)C1=CC=CC=C1

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PubChem CID	785330
CAS	938-79-4
Molecular Weight (g/mol)	164.20
MDL Number	MFCD00063165
SMILES	CCC(C(O)=O)C1=CC=CC=C1
Synonym	r---2-phenylbutyric acid,2r-2-phenylbutanoic acid,2-phenylbutyric acid, r,r-2-phenylbutyric acid,benzeneacetic acid, alpha-ethyl-, r,r-2-phenylbutanoic acid,2r-2-phenyl-butanoic acid,2r-2-phenyl-mutanoic acid,r---2-phenylbutanoic acid,benzeneacetic acid,a-ethyl-, ar
IUPAC Name	(2R)-2-phenylbutanoic acid
InChI Key	OFJWFSNDPCAWDK-UHFFFAOYNA-N
Molecular Formula	C10H12O2

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4-n-Propylphenol, 98%

CAS: 645-56-7 Molecular Formula: C9H12O Molecular Weight (g/mol): 136.194 MDL Number: MFCD00002395 InChI Key: KLSLBUSXWBJMEC-UHFFFAOYSA-N Synonym: 4-n-propylphenol,p-propylphenol,phenol, 4-propyl,dihydrochavicol,phenol, p-propyl,1-hydroxy-4-n-propylbenzene,p-n-propylphenol,4-propyl-phenol,p-hydroxypropylbenzene,hydroxypropylbenzene, p PubChem CID: 12580 ChEBI: CHEBI:34434 IUPAC Name: 4-propylphenol SMILES: CCCC1=CC=C(C=C1)O

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PubChem CID	12580
CAS	645-56-7
Molecular Weight (g/mol)	136.194
ChEBI	CHEBI:34434
MDL Number	MFCD00002395
SMILES	CCCC1=CC=C(C=C1)O
Synonym	4-n-propylphenol,p-propylphenol,phenol, 4-propyl,dihydrochavicol,phenol, p-propyl,1-hydroxy-4-n-propylbenzene,p-n-propylphenol,4-propyl-phenol,p-hydroxypropylbenzene,hydroxypropylbenzene, p
IUPAC Name	4-propylphenol
InChI Key	KLSLBUSXWBJMEC-UHFFFAOYSA-N
Molecular Formula	C9H12O

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2-Phenyl-2-propanol, 98+%

CAS: 617-94-7 Molecular Formula: C9H12O Molecular Weight (g/mol): 136.19 MDL Number: MFCD00004456 InChI Key: BDCFWIDZNLCTMF-UHFFFAOYSA-N Synonym: 2-phenyl-2-propanol,dimethylphenylcarbinol,1-hydroxycumene,dimethylphenylmethanol,alpha-cumyl alcohol,phenyldimethylcarbinol,2-propanol, 2-phenyl,2-phenylisopropanol,alpha,alpha-dimethylbenzyl alcohol,2-phenyl-propan-2-ol PubChem CID: 12053 IUPAC Name: 2-phenylpropan-2-ol SMILES: CC(C)(O)C1=CC=CC=C1

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PubChem CID	12053
CAS	617-94-7
Molecular Weight (g/mol)	136.19
MDL Number	MFCD00004456
SMILES	CC(C)(O)C1=CC=CC=C1
Synonym	2-phenyl-2-propanol,dimethylphenylcarbinol,1-hydroxycumene,dimethylphenylmethanol,alpha-cumyl alcohol,phenyldimethylcarbinol,2-propanol, 2-phenyl,2-phenylisopropanol,alpha,alpha-dimethylbenzyl alcohol,2-phenyl-propan-2-ol
IUPAC Name	2-phenylpropan-2-ol
InChI Key	BDCFWIDZNLCTMF-UHFFFAOYSA-N
Molecular Formula	C9H12O

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4-(tert-Butyl)benzylchloride, 97%

CAS: 19692-45-6 Molecular Formula: C11H15Cl Molecular Weight (g/mol): 182.69 MDL Number: MFCD00000918 InChI Key: WAXIFMGAKWIFDQ-UHFFFAOYSA-N Synonym: 4-tert-butylbenzyl chloride,1-tert-butyl-4-chloromethyl benzene,p-tert-butylbenzyl chloride,4-tert-butyl benzyl chloride,benzene, 1-chloromethyl-4-1,1-dimethylethyl,4-tert-butyl benzylchloride,p-t-butylbenzyl chloride,1-chloromethyl-4-tert-butylbenzene,p-tert-butyl-.alpha.-chlorotoluene PubChem CID: 88198 IUPAC Name: 1-tert-butyl-4-(chloromethyl)benzene SMILES: CC(C)(C)C1=CC=C(CCl)C=C1

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PubChem CID	88198
CAS	19692-45-6
Molecular Weight (g/mol)	182.69
MDL Number	MFCD00000918
SMILES	CC(C)(C)C1=CC=C(CCl)C=C1
Synonym	4-tert-butylbenzyl chloride,1-tert-butyl-4-chloromethyl benzene,p-tert-butylbenzyl chloride,4-tert-butyl benzyl chloride,benzene, 1-chloromethyl-4-1,1-dimethylethyl,4-tert-butyl benzylchloride,p-t-butylbenzyl chloride,1-chloromethyl-4-tert-butylbenzene,p-tert-butyl-.alpha.-chlorotoluene
IUPAC Name	1-tert-butyl-4-(chloromethyl)benzene
InChI Key	WAXIFMGAKWIFDQ-UHFFFAOYSA-N
Molecular Formula	C11H15Cl

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PubChem CID	7381
CAS	98-29-3
Molecular Weight (g/mol)	166.22
MDL Number	MFCD00002201
SMILES	CC(C)(C)C1=CC=C(O)C(O)=C1
Synonym	4-tert-butylcatechol,p-tert-butylcatechol,4-tert-butylpyrocatechol,p-tert-butyl catechol,4-tert-butyl benzene-1,2-diol,4-t-butylpyrocatechol,p-tert-butylpyrocatechol,4-t-butylcatechol,1,2-benzenediol, 4-1,1-dimethylethyl,4-tert-butylcatechin
IUPAC Name	4-tert-butylbenzene-1,2-diol
InChI Key	XESZUVZBAMCAEJ-UHFFFAOYSA-N
Molecular Formula	C10H14O2

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