Alcohols and polyols

Organic compounds containing one or more hydroxyl functional groups bonded to a carbon atom; hydroxyls consist of an oxygen atom bonded to a hydrogen atom. Alcohols exist in chain, or as closed rings. Polyols contain two or more hydroxyl groups.

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Propylene Glycol (USP/FCC), Fisher Chemical™

CAS: 57-55-6 Molecular Formula: C3H8O2 Molecular Weight (g/mol): 76.095 MDL Number: MFCD00064272 InChI Key: DNIAPMSPPWPWGF-UHFFFAOYSA-N Synonym: 1,2-propanediol,propylene glycol,1,2-dihydroxypropane,2-hydroxypropanol,1,2-propylene glycol,methylethyl glycol,methylethylene glycol,monopropylene glycol,isopropylene glycol,dowfrost PubChem CID: 1030 ChEBI: CHEBI:16997 IUPAC Name: propane-1,2-diol SMILES: CC(CO)O

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PubChem CID	1030
CAS	57-55-6
Molecular Weight (g/mol)	76.095
ChEBI	CHEBI:16997
MDL Number	MFCD00064272
SMILES	CC(CO)O
Synonym	1,2-propanediol,propylene glycol,1,2-dihydroxypropane,2-hydroxypropanol,1,2-propylene glycol,methylethyl glycol,methylethylene glycol,monopropylene glycol,isopropylene glycol,dowfrost
IUPAC Name	propane-1,2-diol
InChI Key	DNIAPMSPPWPWGF-UHFFFAOYSA-N
Molecular Formula	C3H8O2

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Isoamyl Alcohol (Clear, Colorless/Certified ACS), Fisher Chemical™

CAS: 123-51-3 Molecular Formula: C5H12O Molecular Weight (g/mol): 88.15 MDL Number: MFCD00002934 InChI Key: PHTQWCKDNZKARW-UHFFFAOYSA-N Synonym: 3-methyl-1-butanol,isoamyl alcohol,isopentyl alcohol,isopentanol,3-methylbutanol,1-butanol, 3-methyl,isoamylol,isobutylcarbinol,iso-amylalkohol,isobutyl carbinol PubChem CID: 31260 ChEBI: CHEBI:15837 IUPAC Name: 3-methylbutan-1-ol SMILES: CC(C)CCO

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PubChem CID	31260
CAS	123-51-3
Molecular Weight (g/mol)	88.15
ChEBI	CHEBI:15837
MDL Number	MFCD00002934
SMILES	CC(C)CCO
Synonym	3-methyl-1-butanol,isoamyl alcohol,isopentyl alcohol,isopentanol,3-methylbutanol,1-butanol, 3-methyl,isoamylol,isobutylcarbinol,iso-amylalkohol,isobutyl carbinol
IUPAC Name	3-methylbutan-1-ol
InChI Key	PHTQWCKDNZKARW-UHFFFAOYSA-N
Molecular Formula	C5H12O

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Phenethyl alcohol, 99%

CAS: 60-12-8 Molecular Formula: C8H10O Molecular Weight (g/mol): 122.17 MDL Number: MFCD00002886 InChI Key: WRMNZCZEMHIOCP-UHFFFAOYSA-N Synonym: phenethyl alcohol,benzeneethanol,phenylethyl alcohol,benzyl carbinol,phenylethanol,phenethanol,2-phenylethyl alcohol,2-phenyl-ethanol,beta-phenylethanol,2-phenylethan-1-ol PubChem CID: 6054 ChEBI: CHEBI:49000 SMILES: OCCC1=CC=CC=C1

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PubChem CID	6054
CAS	60-12-8
Molecular Weight (g/mol)	122.17
ChEBI	CHEBI:49000
MDL Number	MFCD00002886
SMILES	OCCC1=CC=CC=C1
Synonym	phenethyl alcohol,benzeneethanol,phenylethyl alcohol,benzyl carbinol,phenylethanol,phenethanol,2-phenylethyl alcohol,2-phenyl-ethanol,beta-phenylethanol,2-phenylethan-1-ol
InChI Key	WRMNZCZEMHIOCP-UHFFFAOYSA-N
Molecular Formula	C8H10O

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Pyrogallol (Crystalline/Certified ACS), Fisher Chemical™

CAS: 87-66-1 Molecular Formula: C6H6O3 Molecular Weight (g/mol): 126.11 MDL Number: MFCD00002192 InChI Key: WQGWDDDVZFFDIG-UHFFFAOYSA-N Synonym: pyrogallol,1,2,3-trihydroxybenzene,pyrogallic acid,1,2,3-benzenetriol,fouramine brown ap,fourrine pg,fourrine 85,pyro,c.i. oxidation base 32,piral PubChem CID: 1057 ChEBI: CHEBI:16164 IUPAC Name: benzene-1,2,3-triol SMILES: OC1=CC=CC(O)=C1O

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PubChem CID	1057
CAS	87-66-1
Molecular Weight (g/mol)	126.11
ChEBI	CHEBI:16164
MDL Number	MFCD00002192
SMILES	OC1=CC=CC(O)=C1O
Synonym	pyrogallol,1,2,3-trihydroxybenzene,pyrogallic acid,1,2,3-benzenetriol,fouramine brown ap,fourrine pg,fourrine 85,pyro,c.i. oxidation base 32,piral
IUPAC Name	benzene-1,2,3-triol
InChI Key	WQGWDDDVZFFDIG-UHFFFAOYSA-N
Molecular Formula	C6H6O3

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3-Pentyn-1-ol, 99%

CAS: 10229-10-4 Molecular Formula: C₅H₈O Molecular Weight (g/mol): 84.12 MDL Number: MFCD00002956 InChI Key: IDYNOORNKYEHHO-UHFFFAOYSA-N Synonym: 3-pentyn-1-ol,3-pentynol,acmc-1bxad PubChem CID: 66295 IUPAC Name: pent-3-yn-1-ol SMILES: CC#CCCO

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Specifications

PubChem CID	66295
CAS	10229-10-4
Molecular Weight (g/mol)	84.12
MDL Number	MFCD00002956
SMILES	CC#CCCO
Synonym	3-pentyn-1-ol,3-pentynol,acmc-1bxad
IUPAC Name	pent-3-yn-1-ol
InChI Key	IDYNOORNKYEHHO-UHFFFAOYSA-N
Molecular Formula	C₅H₈O

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2-Mercaptoethanol, 99%, pure

CAS: 60-24-2 Molecular Formula: C2H6OS Molecular Weight (g/mol): 78.13 MDL Number: MFCD00004890 InChI Key: DGVVWUTYPXICAM-UHFFFAOYSA-N Synonym: 2-mercaptoethanol,mercaptoethanol,thioglycol,beta-mercaptoethanol,ethanol, 2-mercapto,2-thioethanol,2-hydroxy-1-ethanethiol,thioethylene glycol,2-hydroxyethanethiol,2-hydroxyethyl mercaptan PubChem CID: 1567 ChEBI: CHEBI:41218 SMILES: OCCS

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PubChem CID	1567
CAS	60-24-2
Molecular Weight (g/mol)	78.13
ChEBI	CHEBI:41218
MDL Number	MFCD00004890
SMILES	OCCS
Synonym	2-mercaptoethanol,mercaptoethanol,thioglycol,beta-mercaptoethanol,ethanol, 2-mercapto,2-thioethanol,2-hydroxy-1-ethanethiol,thioethylene glycol,2-hydroxyethanethiol,2-hydroxyethyl mercaptan
InChI Key	DGVVWUTYPXICAM-UHFFFAOYSA-N
Molecular Formula	C2H6OS

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2-Mercaptoethanol (Reagent), Fisher Chemical

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Specifications

PubChem CID	1567
CAS	60-24-2
Molecular Weight (g/mol)	78.13
ChEBI	CHEBI:41218
MDL Number	MFCD00004890
SMILES	OCCS
Synonym	2-mercaptoethanol,mercaptoethanol,thioglycol,beta-mercaptoethanol,ethanol, 2-mercapto,2-thioethanol,2-hydroxy-1-ethanethiol,thioethylene glycol,2-hydroxyethanethiol,2-hydroxyethyl mercaptan
IUPAC Name	2-sulfanylethan-1-ol
InChI Key	DGVVWUTYPXICAM-UHFFFAOYSA-N
Molecular Formula	C2H6OS

tert-Butyl alcohol, ACS, 99+%

CAS: 75-65-0 Molecular Formula: C4H10O Molecular Weight (g/mol): 74.123 MDL Number: MFCD00004464 InChI Key: DKGAVHZHDRPRBM-UHFFFAOYSA-N Synonym: tert-butanol,tert-butyl alcohol,2-methyl-2-propanol,t-butanol,t-butyl hydroxide,1,1-dimethylethanol,trimethylcarbinol,trimethyl methanol,2-propanol, 2-methyl,t-butyl alcohol PubChem CID: 6386 ChEBI: CHEBI:45895 IUPAC Name: 2-methylpropan-2-ol SMILES: CC(C)(C)O

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Specifications

PubChem CID	6386
CAS	75-65-0
Molecular Weight (g/mol)	74.123
ChEBI	CHEBI:45895
MDL Number	MFCD00004464
SMILES	CC(C)(C)O
Synonym	tert-butanol,tert-butyl alcohol,2-methyl-2-propanol,t-butanol,t-butyl hydroxide,1,1-dimethylethanol,trimethylcarbinol,trimethyl methanol,2-propanol, 2-methyl,t-butyl alcohol
IUPAC Name	2-methylpropan-2-ol
InChI Key	DKGAVHZHDRPRBM-UHFFFAOYSA-N
Molecular Formula	C4H10O

tert-Butyl alcohol, anhydrous, 99.5%, packaged under Argon in resealable ChemSeal™ bottles

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Specifications

PubChem CID	6386
CAS	75-65-0
Molecular Weight (g/mol)	74.123
ChEBI	CHEBI:45895
MDL Number	MFCD00004464
SMILES	CC(C)(C)O
Synonym	tert-butanol,tert-butyl alcohol,2-methyl-2-propanol,t-butanol,t-butyl hydroxide,1,1-dimethylethanol,trimethylcarbinol,trimethyl methanol,2-propanol, 2-methyl,t-butyl alcohol
IUPAC Name	2-methylpropan-2-ol
InChI Key	DKGAVHZHDRPRBM-UHFFFAOYSA-N
Molecular Formula	C4H10O

Thermo Scientific Chemicals D-Pinitol, 95%

CAS: 10284-63-6 Molecular Formula: C7H14O6 Molecular Weight (g/mol): 194.18 MDL Number: MFCD00216659 InChI Key: DSCFFEYYQKSRSV-FEPQRWDDSA-N Synonym: d-pinitol,pinitol,3-o-methyl-d-chiro-inositol,d-+-pinitol,inzitol,pinit,+-pinitol,methylinositol,sennitol,d-ononitol PubChem CID: 164619 IUPAC Name: (1S,2S,4S,5R)-6-methoxycyclohexane-1,2,3,4,5-pentol SMILES: COC1[C@@H](O)[C@@H](O)C(O)[C@H](O)[C@H]1O

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Specifications

PubChem CID	164619
CAS	10284-63-6
Molecular Weight (g/mol)	194.18
MDL Number	MFCD00216659
SMILES	COC1[C@@H](O)[C@@H](O)C(O)[C@H](O)[C@H]1O
Synonym	d-pinitol,pinitol,3-o-methyl-d-chiro-inositol,d-+-pinitol,inzitol,pinit,+-pinitol,methylinositol,sennitol,d-ononitol
IUPAC Name	(1S,2S,4S,5R)-6-methoxycyclohexane-1,2,3,4,5-pentol
InChI Key	DSCFFEYYQKSRSV-FEPQRWDDSA-N
Molecular Formula	C7H14O6

myo-Inositol, 99%

CAS: 87-89-8 Molecular Formula: C6H12O6 Molecular Weight (g/mol): 180.156 MDL Number: MFCD00077932 InChI Key: CDAISMWEOUEBRE-UHFFFAOYSA-N Synonym: scyllo-inositol,myo-inositol,inositol,muco-inositol,epi-inositol,i-inositol,meso-inositol,allo-inositol,1d-chiro-inositol,myoinositol PubChem CID: 892 ChEBI: CHEBI:24848 IUPAC Name: cyclohexane-1,2,3,4,5,6-hexol SMILES: C1(C(C(C(C(C1O)O)O)O)O)O

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Specifications

PubChem CID	892
CAS	87-89-8
Molecular Weight (g/mol)	180.156
ChEBI	CHEBI:24848
MDL Number	MFCD00077932
SMILES	C1(C(C(C(C(C1O)O)O)O)O)O
Synonym	scyllo-inositol,myo-inositol,inositol,muco-inositol,epi-inositol,i-inositol,meso-inositol,allo-inositol,1d-chiro-inositol,myoinositol
IUPAC Name	cyclohexane-1,2,3,4,5,6-hexol
InChI Key	CDAISMWEOUEBRE-UHFFFAOYSA-N
Molecular Formula	C6H12O6

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Triethylene glycol, 99%

CAS: 112-27-6 Molecular Formula: C6H14O4 Molecular Weight (g/mol): 150.17 MDL Number: MFCD00002880,MFCD00081839,MFCD01779596,MFCD01779599,MFCD01779601,MFCD01779603,MFCD01779605,MFCD01779609,MFCD01779611,MFCD01779612,MFCD01779614,MFCD01779615,MFCD01779616 InChI Key: ZIBGPFATKBEMQZ-UHFFFAOYSA-N Synonym: triethylene glycol,triglycol,2,2'-ethane-1,2-diylbis oxy diethanol,trigen,triethylenglykol,triethyleneglycol,2,2'-ethylenedioxydiethanol,1,2-bis 2-hydroxyethoxy ethane,3,6-dioxaoctane-1,8-diol,2,2'-ethylenedioxy diethanol PubChem CID: 8172 ChEBI: CHEBI:44926 IUPAC Name: 2-[2-(2-hydroxyethoxy)ethoxy]ethanol SMILES: OCCOCCOCCO

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Specifications

PubChem CID	8172
CAS	112-27-6
Molecular Weight (g/mol)	150.17
ChEBI	CHEBI:44926
MDL Number	MFCD00002880,MFCD00081839,MFCD01779596,MFCD01779599,MFCD01779601,MFCD01779603,MFCD01779605,MFCD01779609,MFCD01779611,MFCD01779612,MFCD01779614,MFCD01779615,MFCD01779616
SMILES	OCCOCCOCCO
Synonym	triethylene glycol,triglycol,2,2'-ethane-1,2-diylbis oxy diethanol,trigen,triethylenglykol,triethyleneglycol,2,2'-ethylenedioxydiethanol,1,2-bis 2-hydroxyethoxy ethane,3,6-dioxaoctane-1,8-diol,2,2'-ethylenedioxy diethanol
IUPAC Name	2-[2-(2-hydroxyethoxy)ethoxy]ethanol
InChI Key	ZIBGPFATKBEMQZ-UHFFFAOYSA-N
Molecular Formula	C6H14O4

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3-Bromo-1-propanol, 95%

CAS: 627-18-9 Molecular Formula: C3H7BrO Molecular Weight (g/mol): 138.99 MDL Number: MFCD00002942 InChI Key: RQFUZUMFPRMVDX-UHFFFAOYSA-N Synonym: 3-bromo-1-propanol,trimethylene bromohydrin,1-propanol, 3-bromo,3-bromopropanol,3-hydroxypropyl bromide,1-bromo-3-propanol,3-bromo-propan-1-ol,ccris 5979,1-bromo-3-hydroxypropane,unii-3t4axh68fh PubChem CID: 12308 IUPAC Name: 3-bromopropan-1-ol SMILES: OCCCBr

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Specifications

PubChem CID	12308
CAS	627-18-9
Molecular Weight (g/mol)	138.99
MDL Number	MFCD00002942
SMILES	OCCCBr
Synonym	3-bromo-1-propanol,trimethylene bromohydrin,1-propanol, 3-bromo,3-bromopropanol,3-hydroxypropyl bromide,1-bromo-3-propanol,3-bromo-propan-1-ol,ccris 5979,1-bromo-3-hydroxypropane,unii-3t4axh68fh
IUPAC Name	3-bromopropan-1-ol
InChI Key	RQFUZUMFPRMVDX-UHFFFAOYSA-N
Molecular Formula	C3H7BrO

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6-Bromo-1-hexanol, 96%

CAS: 4286-55-9 Molecular Formula: C6H13BrO Molecular Weight (g/mol): 181.07 MDL Number: MFCD00002983 InChI Key: FCMCSZXRVWDVAW-UHFFFAOYSA-N Synonym: 6-bromo-1-hexanol,6-bromohexanol,1-hexanol, 6-bromo,6-bromo-hexan-1-ol,hexamethylene bromohydrin,6-bromo-hexanol,6-bromo-l-hexanol,1-bromo-6-hexanol,1-bromohexan-6-ol,6-hydroxyhexyl bromide PubChem CID: 77970 IUPAC Name: 6-bromohexan-1-ol SMILES: OCCCCCCBr

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Specifications

PubChem CID	77970
CAS	4286-55-9
Molecular Weight (g/mol)	181.07
MDL Number	MFCD00002983
SMILES	OCCCCCCBr
Synonym	6-bromo-1-hexanol,6-bromohexanol,1-hexanol, 6-bromo,6-bromo-hexan-1-ol,hexamethylene bromohydrin,6-bromo-hexanol,6-bromo-l-hexanol,1-bromo-6-hexanol,1-bromohexan-6-ol,6-hydroxyhexyl bromide
IUPAC Name	6-bromohexan-1-ol
InChI Key	FCMCSZXRVWDVAW-UHFFFAOYSA-N
Molecular Formula	C6H13BrO

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Solketal, 97%

CAS: 100-79-8 Molecular Formula: C6H12O3 Molecular Weight (g/mol): 132.159 MDL Number: MFCD00063238 InChI Key: RNVYQYLELCKWAN-UHFFFAOYSA-N Synonym: solketal,2,2-dimethyl-1,3-dioxolane-4-methanol,2,2-dimethyl-1,3-dioxolan-4-yl methanol,glycerolacetone,dioxolan,isopropylidene glycerol,1,2-isopropylideneglycerol,1,2-o-isopropylideneglycerol,1,3-dioxolane-4-methanol, 2,2-dimethyl,glycerol dimethylketal PubChem CID: 7528 IUPAC Name: (2,2-dimethyl-1,3-dioxolan-4-yl)methanol SMILES: CC1(OCC(O1)CO)C

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Specifications

PubChem CID	7528
CAS	100-79-8
Molecular Weight (g/mol)	132.159
MDL Number	MFCD00063238
SMILES	CC1(OCC(O1)CO)C
Synonym	solketal,2,2-dimethyl-1,3-dioxolane-4-methanol,2,2-dimethyl-1,3-dioxolan-4-yl methanol,glycerolacetone,dioxolan,isopropylidene glycerol,1,2-isopropylideneglycerol,1,2-o-isopropylideneglycerol,1,3-dioxolane-4-methanol, 2,2-dimethyl,glycerol dimethylketal
IUPAC Name	(2,2-dimethyl-1,3-dioxolan-4-yl)methanol
InChI Key	RNVYQYLELCKWAN-UHFFFAOYSA-N
Molecular Formula	C6H12O3

Alcohols and polyols

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