Heteroaromatic compounds

Organic compounds that contain one or more heterocycles that are aromatic; heterocycles are rings that contain atoms from two or more types of elements.

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2-Phenylthiophene, 95%

CAS: 825-55-8 Molecular Formula: C10H8S Molecular Weight (g/mol): 160.234 MDL Number: MFCD00130080 InChI Key: PJRGDKFLFAYRBV-UHFFFAOYSA-N Synonym: thiophene, 2-phenyl,2-phenyl-thiophene,phenylthiophene,thiophene, phenyl,2-thienylbenzene,2-phenyithiophene,2-phenylthiofuran,2-phenylthiophene,acmc-209ppe PubChem CID: 69999 IUPAC Name: 2-phenylthiophene SMILES: C1=CC=C(C=C1)C2=CC=CS2

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PubChem CID	69999
CAS	825-55-8
Molecular Weight (g/mol)	160.234
MDL Number	MFCD00130080
SMILES	C1=CC=C(C=C1)C2=CC=CS2
Synonym	thiophene, 2-phenyl,2-phenyl-thiophene,phenylthiophene,thiophene, phenyl,2-thienylbenzene,2-phenyithiophene,2-phenylthiofuran,2-phenylthiophene,acmc-209ppe
IUPAC Name	2-phenylthiophene
InChI Key	PJRGDKFLFAYRBV-UHFFFAOYSA-N
Molecular Formula	C10H8S

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Thianaphthene, 97%

CAS: 95-15-8 Molecular Formula: C₈H₆S Molecular Weight (g/mol): 134.2 MDL Number: MFCD00005864 InChI Key: FCEHBMOGCRZNNI-UHFFFAOYSA-N Synonym: benzo b thiophene,thianaphthene,benzothiophene,benzothiofuran,thionaphthene,1-thiaindene,thianaphthen,benzothiophen,thianaphtene,1-benzothiophen PubChem CID: 7221 ChEBI: CHEBI:35858 IUPAC Name: 1-benzothiophene SMILES: C1=CC=C2C(=C1)C=CS2

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PubChem CID	7221
CAS	95-15-8
Molecular Weight (g/mol)	134.2
ChEBI	CHEBI:35858
MDL Number	MFCD00005864
SMILES	C1=CC=C2C(=C1)C=CS2
Synonym	benzo b thiophene,thianaphthene,benzothiophene,benzothiofuran,thionaphthene,1-thiaindene,thianaphthen,benzothiophen,thianaphtene,1-benzothiophen
IUPAC Name	1-benzothiophene
InChI Key	FCEHBMOGCRZNNI-UHFFFAOYSA-N
Molecular Formula	C₈H₆S

Pyridine, 99.8%, for biochemistry, AcroSeal™, Thermo Scientific Chemicals

CAS: 110-86-1 Molecular Formula: C₅H₅N Molecular Weight (g/mol): 79.1 InChI Key: JUJWROOIHBZHMG-UHFFFAOYSA-N Synonym: azabenzene,azine,pyridin,piridina,pirydyna,pyridin german,pirydyna polish,piridina italian,rcra waste number u196,caswell no. 717 PubChem CID: 1049 ChEBI: CHEBI:16227 IUPAC Name: pyridine SMILES: C1=CC=NC=C1

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PubChem CID	1049
CAS	110-86-1
Molecular Weight (g/mol)	79.1
ChEBI	CHEBI:16227
SMILES	C1=CC=NC=C1
Synonym	azabenzene,azine,pyridin,piridina,pirydyna,pyridin german,pirydyna polish,piridina italian,rcra waste number u196,caswell no. 717
IUPAC Name	pyridine
InChI Key	JUJWROOIHBZHMG-UHFFFAOYSA-N
Molecular Formula	C₅H₅N

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2,3-Dimethylthiophene, 97%

CAS: 632-16-6 Molecular Formula: C6H8S Molecular Weight (g/mol): 112.19 MDL Number: MFCD00130081 InChI Key: BZYUMXXOAYSFOW-UHFFFAOYSA-N Synonym: thiophene, 2,3-dimethyl,2,3-dimethyl-thiophene,2,3,dimethylthiophene,pubchem7751,2.3-dimethylthiophene,dimethylthiophene,2,3-dirnethylthiophene PubChem CID: 34295 IUPAC Name: 2,3-dimethylthiophene SMILES: CC1=C(C)C=CS1

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PubChem CID	34295
CAS	632-16-6
Molecular Weight (g/mol)	112.19
MDL Number	MFCD00130081
SMILES	CC1=C(C)C=CS1
Synonym	thiophene, 2,3-dimethyl,2,3-dimethyl-thiophene,2,3,dimethylthiophene,pubchem7751,2.3-dimethylthiophene,dimethylthiophene,2,3-dirnethylthiophene
IUPAC Name	2,3-dimethylthiophene
InChI Key	BZYUMXXOAYSFOW-UHFFFAOYSA-N
Molecular Formula	C6H8S

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3-(5-Methyl-2-furyl)butyraldehyde, 99%

CAS: 31704-80-0 Molecular Formula: C9H12O2 Molecular Weight (g/mol): 152.19 MDL Number: MFCD00209519 InChI Key: PFLUFBMKOXFWSD-UHFFFAOYNA-N Synonym: 3-5-methyl-2-furyl butyraldehyde,3-5-methylfuran-2-yl butanal,3-5-methyl-2-furyl butanal,3-5-methyl-2-furanyl butanal,fema no. 3307,beta5-dimethyl-2-furanpropanal,2-furanpropanal, beta5-dimethyl,2-furanpropanal, beta,5-dimethyl,beta5-dimethyl-2-furanpropionaldehyde,2-furanpropanal, .beta.,5-dimethyl PubChem CID: 3578033 IUPAC Name: 3-(5-methylfuran-2-yl)butanal SMILES: CCC(C=O)C1=CC=C(C)O1

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PubChem CID	3578033
CAS	31704-80-0
Molecular Weight (g/mol)	152.19
MDL Number	MFCD00209519
SMILES	CCC(C=O)C1=CC=C(C)O1
Synonym	3-5-methyl-2-furyl butyraldehyde,3-5-methylfuran-2-yl butanal,3-5-methyl-2-furyl butanal,3-5-methyl-2-furanyl butanal,fema no. 3307,beta5-dimethyl-2-furanpropanal,2-furanpropanal, beta5-dimethyl,2-furanpropanal, beta,5-dimethyl,beta5-dimethyl-2-furanpropionaldehyde,2-furanpropanal, .beta.,5-dimethyl
IUPAC Name	3-(5-methylfuran-2-yl)butanal
InChI Key	PFLUFBMKOXFWSD-UHFFFAOYNA-N
Molecular Formula	C9H12O2

2-(Bromomethyl)-5-(trifluoromethyl)furan, 97%, Thermo Scientific™

CAS: 17515-77-4 Molecular Formula: C6H4BrF3O Molecular Weight (g/mol): 229.00 MDL Number: MFCD03086219 InChI Key: YNHVBNGRNNVEMD-UHFFFAOYSA-N Synonym: 2-bromomethyl-5-trifluoromethyl furan,2-bromomethyl-5-trifluoromethyl-furan,furan, 2-bromomethyl-5-trifluoromethyl,pubchem13345,5-trifluoromethyl furfuryl bromide,2-bromomethyl-5-trifloromethyl furan,5-bromomethyl-2-trifluoromethyl furan PubChem CID: 2794605 IUPAC Name: 2-(bromomethyl)-5-(trifluoromethyl)furan SMILES: FC(F)(F)C1=CC=C(CBr)O1

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PubChem CID	2794605
CAS	17515-77-4
Molecular Weight (g/mol)	229.00
MDL Number	MFCD03086219
SMILES	FC(F)(F)C1=CC=C(CBr)O1
Synonym	2-bromomethyl-5-trifluoromethyl furan,2-bromomethyl-5-trifluoromethyl-furan,furan, 2-bromomethyl-5-trifluoromethyl,pubchem13345,5-trifluoromethyl furfuryl bromide,2-bromomethyl-5-trifloromethyl furan,5-bromomethyl-2-trifluoromethyl furan
IUPAC Name	2-(bromomethyl)-5-(trifluoromethyl)furan
InChI Key	YNHVBNGRNNVEMD-UHFFFAOYSA-N
Molecular Formula	C6H4BrF3O

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3(5)-Phenyl-1H-pyrazole, 99+%

CAS: 2458-26-6 Molecular Formula: C9H8N2 Molecular Weight (g/mol): 144.18 MDL Number: MFCD00159654 InChI Key: OEDUIFSDODUDRK-UHFFFAOYSA-N Synonym: 3-phenyl-1h-pyrazole,3-phenylpyrazole,1h-pyrazole, 3-phenyl,pyrazole, 3-phenyl,3-benzylpyrazole,3-phenylpyrazol,phenylpyrazole,3-phenyl-2h-pyrazole,chembl38876,5-phenylpyrazole PubChem CID: 17155 IUPAC Name: 5-phenyl-1H-pyrazole SMILES: N1N=CC=C1C1=CC=CC=C1

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PubChem CID	17155
CAS	2458-26-6
Molecular Weight (g/mol)	144.18
MDL Number	MFCD00159654
SMILES	N1N=CC=C1C1=CC=CC=C1
Synonym	3-phenyl-1h-pyrazole,3-phenylpyrazole,1h-pyrazole, 3-phenyl,pyrazole, 3-phenyl,3-benzylpyrazole,3-phenylpyrazol,phenylpyrazole,3-phenyl-2h-pyrazole,chembl38876,5-phenylpyrazole
IUPAC Name	5-phenyl-1H-pyrazole
InChI Key	OEDUIFSDODUDRK-UHFFFAOYSA-N
Molecular Formula	C9H8N2

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5-Methylquinoxaline, 98%

CAS: 13708-12-8 Molecular Formula: C9H8N2 Molecular Weight (g/mol): 144.177 MDL Number: MFCD00012335 InChI Key: CQLOYHZZZCWHSG-UHFFFAOYSA-N Synonym: quinoxaline, 5-methyl,unii-l0ad7t152g,5-methyl quinoxaline,fema no. 3203,8-methylquinoxaline,5-methyl-quinoxaline,acmc-209caq,5-methylquinoxaline,dsstox_cid_27090 PubChem CID: 61670 IUPAC Name: 5-methylquinoxaline SMILES: CC1=C2C(=CC=C1)N=CC=N2

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PubChem CID	61670
CAS	13708-12-8
Molecular Weight (g/mol)	144.177
MDL Number	MFCD00012335
SMILES	CC1=C2C(=CC=C1)N=CC=N2
Synonym	quinoxaline, 5-methyl,unii-l0ad7t152g,5-methyl quinoxaline,fema no. 3203,8-methylquinoxaline,5-methyl-quinoxaline,acmc-209caq,5-methylquinoxaline,dsstox_cid_27090
IUPAC Name	5-methylquinoxaline
InChI Key	CQLOYHZZZCWHSG-UHFFFAOYSA-N
Molecular Formula	C9H8N2

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3-Thiophenemethanol, 97%

CAS: 71637-34-8 Molecular Formula: C5H6OS Molecular Weight (g/mol): 114.16 MDL Number: MFCD00014534 InChI Key: BOWIFWCBNWWZOG-UHFFFAOYSA-N Synonym: 3-thiophenemethanol,3-thienylmethanol,thiophene-3-methanol,3-thiophene methanol,3-hydroxymethylthiophene,thien-3-ylmethanol,thiophen-3-yl methanol,3-thienylmethan-1-ol,3-hydroxymethyl thiophene,3-thiophenylmethanol PubChem CID: 123570 IUPAC Name: thiophen-3-ylmethanol SMILES: OCC1=CSC=C1

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PubChem CID	123570
CAS	71637-34-8
Molecular Weight (g/mol)	114.16
MDL Number	MFCD00014534
SMILES	OCC1=CSC=C1
Synonym	3-thiophenemethanol,3-thienylmethanol,thiophene-3-methanol,3-thiophene methanol,3-hydroxymethylthiophene,thien-3-ylmethanol,thiophen-3-yl methanol,3-thienylmethan-1-ol,3-hydroxymethyl thiophene,3-thiophenylmethanol
IUPAC Name	thiophen-3-ylmethanol
InChI Key	BOWIFWCBNWWZOG-UHFFFAOYSA-N
Molecular Formula	C5H6OS

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1H-Pyrazole-3,5-dicarboxylic acid monohydrate, 98%

CAS: 303180-11-2 Molecular Formula: C5H6N2O5 Molecular Weight (g/mol): 174.112 MDL Number: MFCD00149323 InChI Key: GLINCONFUZIMCN-UHFFFAOYSA-N Synonym: 1h-pyrazole-3,5-dicarboxylic acid hydrate,3,5-pyrazoledicarboxylic acid monohydrate,1h-pyrazole-3,5-dicarboxylic acid monohydrate,pyrazole-3,5-dicarboxylic acid, hydrate,acmc-1aezk,3,5-pyrazoledicarboxylic acid hydrate,1h-pyrazole-3,5-dicarboxylicacidmonohydrate,1h-pyrazole-3,5-dicarboxylic acid; hydrate,1h-pyrazole-3,5-dicarboxylic acid hydrate 1:1 PubChem CID: 2723723 IUPAC Name: 1H-pyrazole-3,5-dicarboxylic acid;hydrate SMILES: C1=C(NN=C1C(=O)O)C(=O)O.O

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PubChem CID	2723723
CAS	303180-11-2
Molecular Weight (g/mol)	174.112
MDL Number	MFCD00149323
SMILES	C1=C(NN=C1C(=O)O)C(=O)O.O
Synonym	1h-pyrazole-3,5-dicarboxylic acid hydrate,3,5-pyrazoledicarboxylic acid monohydrate,1h-pyrazole-3,5-dicarboxylic acid monohydrate,pyrazole-3,5-dicarboxylic acid, hydrate,acmc-1aezk,3,5-pyrazoledicarboxylic acid hydrate,1h-pyrazole-3,5-dicarboxylicacidmonohydrate,1h-pyrazole-3,5-dicarboxylic acid; hydrate,1h-pyrazole-3,5-dicarboxylic acid hydrate 1:1
IUPAC Name	1H-pyrazole-3,5-dicarboxylic acid;hydrate
InChI Key	GLINCONFUZIMCN-UHFFFAOYSA-N
Molecular Formula	C5H6N2O5

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2-Hydroxybenzothiazole, 98%

CAS: 934-34-9 Molecular Formula: C7H5NOS Molecular Weight (g/mol): 151.183 MDL Number: MFCD00022868 InChI Key: YEDUAINPPJYDJZ-UHFFFAOYSA-N Synonym: benzothiazolone,2-hydroxybenzothiazole,2 3h-benzothiazolone,2-benzothiazolol,2-benzothiazolone,1,3-benzothiazol-2-ol,2-benzothiazolinone,3h-benzothiazol-2-one,benzothiazolol,benzo d thiazol-2 3h-one PubChem CID: 13625 ChEBI: CHEBI:115196 IUPAC Name: 3H-1,3-benzothiazol-2-one SMILES: C1=CC=C2C(=C1)NC(=O)S2

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PubChem CID	13625
CAS	934-34-9
Molecular Weight (g/mol)	151.183
ChEBI	CHEBI:115196
MDL Number	MFCD00022868
SMILES	C1=CC=C2C(=C1)NC(=O)S2
Synonym	benzothiazolone,2-hydroxybenzothiazole,2 3h-benzothiazolone,2-benzothiazolol,2-benzothiazolone,1,3-benzothiazol-2-ol,2-benzothiazolinone,3h-benzothiazol-2-one,benzothiazolol,benzo d thiazol-2 3h-one
IUPAC Name	3H-1,3-benzothiazol-2-one
InChI Key	YEDUAINPPJYDJZ-UHFFFAOYSA-N
Molecular Formula	C7H5NOS

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2-Phenylthiazole, 98%

CAS: 1826-11-5 Molecular Formula: C₉H₇NS Molecular Weight (g/mol): 161.23 InChI Key: WYKHSBAVLOPISI-UHFFFAOYSA-N Synonym: 2-phenylthiazole,thiazole, 2-phenyl,phenylthiazole,2-phenyl thiazole,#,ksc174s8f,tpc-i164 PubChem CID: 547494 IUPAC Name: 2-phenyl-1,3-thiazole SMILES: C1=CC=C(C=C1)C2=NC=CS2

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PubChem CID	547494
CAS	1826-11-5
Molecular Weight (g/mol)	161.23
SMILES	C1=CC=C(C=C1)C2=NC=CS2
Synonym	2-phenylthiazole,thiazole, 2-phenyl,phenylthiazole,2-phenyl thiazole,#,ksc174s8f,tpc-i164
IUPAC Name	2-phenyl-1,3-thiazole
InChI Key	WYKHSBAVLOPISI-UHFFFAOYSA-N
Molecular Formula	C₉H₇NS

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Nicotinamide N-oxide, 98%

CAS: 1986-81-8 Molecular Formula: C6H6N2O2 Molecular Weight (g/mol): 138.126 MDL Number: MFCD00006202 InChI Key: USSFUVKEHXDAPM-UHFFFAOYSA-N PubChem CID: 72661 IUPAC Name: 1-oxidopyridin-1-ium-3-carboxamide SMILES: C1=CC(=C[N+](=C1)[O-])C(=O)N

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PubChem CID	72661
CAS	1986-81-8
Molecular Weight (g/mol)	138.126
MDL Number	MFCD00006202
SMILES	C1=CC(=C[N+](=C1)[O-])C(=O)N
IUPAC Name	1-oxidopyridin-1-ium-3-carboxamide
InChI Key	USSFUVKEHXDAPM-UHFFFAOYSA-N
Molecular Formula	C6H6N2O2

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4,7-Phenanthroline, 98%

CAS: 230-07-9 Molecular Formula: C₁₂H₈N₂ Molecular Weight (g/mol): 180.21 MDL Number: MFCD00004987 InChI Key: DATYUTWESAKQQM-UHFFFAOYSA-N Synonym: 4,7 phenanthroline,pyridino 3,2-f quinoline,acmc-1conx,4,7-phenanthroline,bidd:gt0447,chembl81429 PubChem CID: 67472 ChEBI: CHEBI:36419 IUPAC Name: 4,7-phenanthroline SMILES: C1=CC2=C(C=CC3=C2C=CC=N3)N=C1

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PubChem CID	67472
CAS	230-07-9
Molecular Weight (g/mol)	180.21
ChEBI	CHEBI:36419
MDL Number	MFCD00004987
SMILES	C1=CC2=C(C=CC3=C2C=CC=N3)N=C1
Synonym	4,7 phenanthroline,pyridino 3,2-f quinoline,acmc-1conx,4,7-phenanthroline,bidd:gt0447,chembl81429
IUPAC Name	4,7-phenanthroline
InChI Key	DATYUTWESAKQQM-UHFFFAOYSA-N
Molecular Formula	C₁₂H₈N₂

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Benzothiazole, 97%

CAS: 95-16-9 Molecular Formula: C₇H₅NS Molecular Weight (g/mol): 135.18 MDL Number: MFCD00005775 InChI Key: IOJUPLGTWVMSFF-UHFFFAOYSA-N Synonym: benzothiazole,benzo d thiazole,benzosulfonazole,1-thia-3-azaindene,vangard bt,benzothiazol,usaf ek-4812,benzthiazole,fema number 3256,unii-g5bw2593ep PubChem CID: 7222 ChEBI: CHEBI:45993 IUPAC Name: 1,3-benzothiazole SMILES: C1=CC=C2C(=C1)N=CS2

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PubChem CID	7222
CAS	95-16-9
Molecular Weight (g/mol)	135.18
ChEBI	CHEBI:45993
MDL Number	MFCD00005775
SMILES	C1=CC=C2C(=C1)N=CS2
Synonym	benzothiazole,benzo d thiazole,benzosulfonazole,1-thia-3-azaindene,vangard bt,benzothiazol,usaf ek-4812,benzthiazole,fema number 3256,unii-g5bw2593ep
IUPAC Name	1,3-benzothiazole
InChI Key	IOJUPLGTWVMSFF-UHFFFAOYSA-N
Molecular Formula	C₇H₅NS

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