Heteroaromatic compounds

256 – 270 of 2,238 results

256

5,6,7,8-Tetrahydroquinoline, 98%

CAS: 10500-57-9 Molecular Formula: C₉H₁₁N Molecular Weight (g/mol): 133.19 InChI Key: YQDGQEKUTLYWJU-UHFFFAOYSA-N Synonym: 2,3-cyclohexeno pyridine,quinoline, 5,6,7,8-tetrahydro,unii-l786aag56h,5,6,7,8-tetra-hydroquinoline,5,6,7,8-tetrahydro-quinoline,pubchem5891,2,3-cyclohexenopyridine,g00034-watson-int,2,3-cyclohexano pyridine,acmc-2098eh PubChem CID: 66335 IUPAC Name: 5,6,7,8-tetrahydroquinoline SMILES: C1CCC2=C(C1)C=CC=N2

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Specifications

PubChem CID	66335
CAS	10500-57-9
Molecular Weight (g/mol)	133.19
SMILES	C1CCC2=C(C1)C=CC=N2
Synonym	2,3-cyclohexeno pyridine,quinoline, 5,6,7,8-tetrahydro,unii-l786aag56h,5,6,7,8-tetra-hydroquinoline,5,6,7,8-tetrahydro-quinoline,pubchem5891,2,3-cyclohexenopyridine,g00034-watson-int,2,3-cyclohexano pyridine,acmc-2098eh
IUPAC Name	5,6,7,8-tetrahydroquinoline
InChI Key	YQDGQEKUTLYWJU-UHFFFAOYSA-N
Molecular Formula	C₉H₁₁N

257

3-(2-Furyl)propanoic acid, 98%

CAS: 935-13-7 Molecular Formula: C₇H₈O₃ Molecular Weight (g/mol): 140.14 InChI Key: XLTJXJJMUFDQEZ-UHFFFAOYSA-N Synonym: 3-furan-2-yl propanoic acid,3-2-furyl propanoic acid,2-furanpropanoic acid,2-furanpropionic acid,3-2-furyl propionic acid,3-furan-2-yl-propionic acid,furan-2-propionic acid,3-2-furyl propoinic acid,furfuryl-essigsaure,furfurylacetic acid PubChem CID: 70286 IUPAC Name: 3-(furan-2-yl)propanoic acid SMILES: C1=COC(=C1)CCC(=O)O

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Specifications

PubChem CID	70286
CAS	935-13-7
Molecular Weight (g/mol)	140.14
SMILES	C1=COC(=C1)CCC(=O)O
Synonym	3-furan-2-yl propanoic acid,3-2-furyl propanoic acid,2-furanpropanoic acid,2-furanpropionic acid,3-2-furyl propionic acid,3-furan-2-yl-propionic acid,furan-2-propionic acid,3-2-furyl propoinic acid,furfuryl-essigsaure,furfurylacetic acid
IUPAC Name	3-(furan-2-yl)propanoic acid
InChI Key	XLTJXJJMUFDQEZ-UHFFFAOYSA-N
Molecular Formula	C₇H₈O₃

258

4-Phenylurazole, 98+%

CAS: 15988-11-1 Molecular Formula: C8H7N3O2 Molecular Weight (g/mol): 177.163 MDL Number: MFCD00005226 InChI Key: GOSUFRDROXZXLN-UHFFFAOYSA-N Synonym: 4-phenylurazole,urazole, 4-phenyl,1,2,4-triazolidine-3,5-dione, 4-phenyl,bicarbamimide, n-phenyl,4-phenyl urazole,4-phenylurazol,4-phenyl-urazole,acmc-1c52y,ksc297q5n PubChem CID: 85229 IUPAC Name: 4-phenyl-1,2,4-triazolidine-3,5-dione SMILES: C1=CC=C(C=C1)N2C(=O)NNC2=O

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Specifications

PubChem CID	85229
CAS	15988-11-1
Molecular Weight (g/mol)	177.163
MDL Number	MFCD00005226
SMILES	C1=CC=C(C=C1)N2C(=O)NNC2=O
Synonym	4-phenylurazole,urazole, 4-phenyl,1,2,4-triazolidine-3,5-dione, 4-phenyl,bicarbamimide, n-phenyl,4-phenyl urazole,4-phenylurazol,4-phenyl-urazole,acmc-1c52y,ksc297q5n
IUPAC Name	4-phenyl-1,2,4-triazolidine-3,5-dione
InChI Key	GOSUFRDROXZXLN-UHFFFAOYSA-N
Molecular Formula	C8H7N3O2

259

3-Pyrimidin-2-ylaniline, 97%, Thermo Scientific™

CAS: 69491-56-1 Molecular Formula: C10H9N3 Molecular Weight (g/mol): 171.203 MDL Number: MFCD09702385 InChI Key: GOCBKTKLGFLECW-UHFFFAOYSA-N Synonym: 3-pyrimidin-2-yl aniline,3-pyrimidin-2-ylphenylamine,2-3-aminophenyl pyrimidine,2-3-aminophenyl-1,3-diazine,benzenamine, 3-2-pyrimidinyl PubChem CID: 12456169 IUPAC Name: 3-pyrimidin-2-ylaniline SMILES: C1=CC(=CC(=C1)N)C2=NC=CC=N2

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Specifications

PubChem CID	12456169
CAS	69491-56-1
Molecular Weight (g/mol)	171.203
MDL Number	MFCD09702385
SMILES	C1=CC(=CC(=C1)N)C2=NC=CC=N2
Synonym	3-pyrimidin-2-yl aniline,3-pyrimidin-2-ylphenylamine,2-3-aminophenyl pyrimidine,2-3-aminophenyl-1,3-diazine,benzenamine, 3-2-pyrimidinyl
IUPAC Name	3-pyrimidin-2-ylaniline
InChI Key	GOCBKTKLGFLECW-UHFFFAOYSA-N
Molecular Formula	C10H9N3

260

5-Phenyl-1H-tetrazole, 99%

CAS: 18039-42-4 Molecular Formula: C7H6N4 Molecular Weight (g/mol): 146.153 MDL Number: MFCD00022388 InChI Key: MARUHZGHZWCEQU-UHFFFAOYSA-N Synonym: 5-phenyl-1h-tetrazole,5-phenyltetrazole,1h-tetrazole, 5-phenyl,2h-tetrazole, 5-phenyl,phenyltetrazole,5-phenyl tetrazole,expandex 5pt,expandex ox 5pt,kempore 50xpt,5-phenyltetrazole van PubChem CID: 87425 IUPAC Name: 5-phenyl-2H-tetrazole SMILES: C1=CC=C(C=C1)C2=NNN=N2

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Specifications

PubChem CID	87425
CAS	18039-42-4
Molecular Weight (g/mol)	146.153
MDL Number	MFCD00022388
SMILES	C1=CC=C(C=C1)C2=NNN=N2
Synonym	5-phenyl-1h-tetrazole,5-phenyltetrazole,1h-tetrazole, 5-phenyl,2h-tetrazole, 5-phenyl,phenyltetrazole,5-phenyl tetrazole,expandex 5pt,expandex ox 5pt,kempore 50xpt,5-phenyltetrazole van
IUPAC Name	5-phenyl-2H-tetrazole
InChI Key	MARUHZGHZWCEQU-UHFFFAOYSA-N
Molecular Formula	C7H6N4

261

3-(1-Methyl-1H-pyrazol-3-yl)benzonitrile, 95%, Thermo Scientific™

CAS: 207909-05-5 Molecular Formula: C11H9N3 Molecular Weight (g/mol): 183.214 MDL Number: MFCD09065009 InChI Key: FLALRGXSUSNEAF-UHFFFAOYSA-N Synonym: 3-1-methyl-1h-pyrazol-3-yl benzonitrile,3-1-methylpyrazol-3-yl benzonitrile,benzonitrile, 3-1-methyl-1h-pyrazol-3-yl,3-1-methylpyrazol-3-yl benzenecarbonitrile PubChem CID: 10655058 IUPAC Name: 3-(1-methylpyrazol-3-yl)benzonitrile SMILES: CN1C=CC(=N1)C2=CC=CC(=C2)C#N

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Specifications

PubChem CID	10655058
CAS	207909-05-5
Molecular Weight (g/mol)	183.214
MDL Number	MFCD09065009
SMILES	CN1C=CC(=N1)C2=CC=CC(=C2)C#N
Synonym	3-1-methyl-1h-pyrazol-3-yl benzonitrile,3-1-methylpyrazol-3-yl benzonitrile,benzonitrile, 3-1-methyl-1h-pyrazol-3-yl,3-1-methylpyrazol-3-yl benzenecarbonitrile
IUPAC Name	3-(1-methylpyrazol-3-yl)benzonitrile
InChI Key	FLALRGXSUSNEAF-UHFFFAOYSA-N
Molecular Formula	C11H9N3

262

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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Specifications

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

263

5-Methylbenzo[b]thiophene, 97%

CAS: 14315-14-1 Molecular Formula: C9H8S Molecular Weight (g/mol): 148.22 MDL Number: MFCD00052509 InChI Key: DOHZWDWNQFZIKH-UHFFFAOYSA-N Synonym: 5-methylbenzo b thiophene,benzo b thiophene, 5-methyl,5-methylbenzothiophene,5-methyl-benzo b thiophene,5-methylthianaphthene,5-methyl-benzothiophene,benzothiophene, 5-mehyl,5-methyl benzo b thiophene PubChem CID: 84346 IUPAC Name: 5-methyl-1-benzothiophene SMILES: CC1=CC=C2SC=CC2=C1

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Specifications

PubChem CID	84346
CAS	14315-14-1
Molecular Weight (g/mol)	148.22
MDL Number	MFCD00052509
SMILES	CC1=CC=C2SC=CC2=C1
Synonym	5-methylbenzo b thiophene,benzo b thiophene, 5-methyl,5-methylbenzothiophene,5-methyl-benzo b thiophene,5-methylthianaphthene,5-methyl-benzothiophene,benzothiophene, 5-mehyl,5-methyl benzo b thiophene
IUPAC Name	5-methyl-1-benzothiophene
InChI Key	DOHZWDWNQFZIKH-UHFFFAOYSA-N
Molecular Formula	C9H8S

264

2-Amino-4-methylpyrimidine, 97%

CAS: 108-52-1 Molecular Formula: C5H7N3 Molecular Weight (g/mol): 109.132 MDL Number: MFCD00006101 InChI Key: GHCFWKFREBNSPC-UHFFFAOYSA-N Synonym: 2-amino-4-methylpyrimidine,2-pyrimidinamine, 4-methyl,6-methyl-2-pyrimidinamine,pyrimidine, 2-amino-4-methyl,4-methyl-2-pyrimidinamine,2-amino-4-methyl-pyrimidine,4-methylpyrimidin-2-ylamine,4-methylpyrimidine-2-ylamine,4-methyl-pyrimidin-2-ylamine,2-amino-6-methylpyrimidine PubChem CID: 7939 IUPAC Name: 4-methylpyrimidin-2-amine SMILES: CC1=NC(=NC=C1)N

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Specifications

PubChem CID	7939
CAS	108-52-1
Molecular Weight (g/mol)	109.132
MDL Number	MFCD00006101
SMILES	CC1=NC(=NC=C1)N
Synonym	2-amino-4-methylpyrimidine,2-pyrimidinamine, 4-methyl,6-methyl-2-pyrimidinamine,pyrimidine, 2-amino-4-methyl,4-methyl-2-pyrimidinamine,2-amino-4-methyl-pyrimidine,4-methylpyrimidin-2-ylamine,4-methylpyrimidine-2-ylamine,4-methyl-pyrimidin-2-ylamine,2-amino-6-methylpyrimidine
IUPAC Name	4-methylpyrimidin-2-amine
InChI Key	GHCFWKFREBNSPC-UHFFFAOYSA-N
Molecular Formula	C5H7N3

265

2-(2-Naphthyl)indole, 98%

CAS: 23746-81-8 Molecular Formula: C18H13N Molecular Weight (g/mol): 243.31 MDL Number: MFCD00124144 InChI Key: CACDYUNTCMPDMI-UHFFFAOYSA-N Synonym: 2-2-naphthyl indole,2-2-naphthyl-1h-indole,2-naphthalen-2-yl-1h-indole,acmc-1chvp,2-2-naphthyl-indol,maybridge1_005904,2-2-indolyl naphthalene,2-1h-indol-2-yl naphthalene,2-2-naphthalenyl-1h-indole PubChem CID: 265232 SMILES: N1C2=CC=CC=C2C=C1C1=CC=C2C=CC=CC2=C1

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Specifications

PubChem CID	265232
CAS	23746-81-8
Molecular Weight (g/mol)	243.31
MDL Number	MFCD00124144
SMILES	N1C2=CC=CC=C2C=C1C1=CC=C2C=CC=CC2=C1
Synonym	2-2-naphthyl indole,2-2-naphthyl-1h-indole,2-naphthalen-2-yl-1h-indole,acmc-1chvp,2-2-naphthyl-indol,maybridge1_005904,2-2-indolyl naphthalene,2-1h-indol-2-yl naphthalene,2-2-naphthalenyl-1h-indole
InChI Key	CACDYUNTCMPDMI-UHFFFAOYSA-N
Molecular Formula	C18H13N

266

3,5-Dimethylbenzo[b]thiophene, 97%

CAS: 1964-45-0 Molecular Formula: C10H10S Molecular Weight (g/mol): 162.25 MDL Number: MFCD00052744 InChI Key: UQJSHXYNNVEGMQ-UHFFFAOYSA-N Synonym: 3,5-dimethylbenzo b thiophene,3,5-dimethyl-benzo b thiophene,3,5-dimethylbenzothiophene,3,5-dimethylthianapthene,benzo b thiophene, 3,5-dimethyl,3,5-dimethyl benzo b thiophene,3,5-dimethyl benzothiophene PubChem CID: 2779875 IUPAC Name: 3,5-dimethyl-1-benzothiophene SMILES: CC1=CC2=C(C=C1)SC=C2C

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Specifications

PubChem CID	2779875
CAS	1964-45-0
Molecular Weight (g/mol)	162.25
MDL Number	MFCD00052744
SMILES	CC1=CC2=C(C=C1)SC=C2C
Synonym	3,5-dimethylbenzo b thiophene,3,5-dimethyl-benzo b thiophene,3,5-dimethylbenzothiophene,3,5-dimethylthianapthene,benzo b thiophene, 3,5-dimethyl,3,5-dimethyl benzo b thiophene,3,5-dimethyl benzothiophene
IUPAC Name	3,5-dimethyl-1-benzothiophene
InChI Key	UQJSHXYNNVEGMQ-UHFFFAOYSA-N
Molecular Formula	C10H10S

267

2-Furylacetone, 99%

CAS: 6975-60-6 Molecular Formula: C7H8O2 Molecular Weight (g/mol): 124.139 MDL Number: MFCD02683084 InChI Key: IQOJTGSBENZIOL-UHFFFAOYSA-N Synonym: 2-furylacetone,furylacetone,2-acetonylfuran,2-propanone, 1-2-furanyl,furfuryl methyl ketone,1-2-furyl-2-propanone,methyl furfuryl ketone,1-2-furanyl-2-propanone,2-furfuryl methyl ketone,2-furyl-2-propanone PubChem CID: 228583 IUPAC Name: 1-(furan-2-yl)propan-2-one SMILES: CC(=O)CC1=CC=CO1

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Specifications

PubChem CID	228583
CAS	6975-60-6
Molecular Weight (g/mol)	124.139
MDL Number	MFCD02683084
SMILES	CC(=O)CC1=CC=CO1
Synonym	2-furylacetone,furylacetone,2-acetonylfuran,2-propanone, 1-2-furanyl,furfuryl methyl ketone,1-2-furyl-2-propanone,methyl furfuryl ketone,1-2-furanyl-2-propanone,2-furfuryl methyl ketone,2-furyl-2-propanone
IUPAC Name	1-(furan-2-yl)propan-2-one
InChI Key	IQOJTGSBENZIOL-UHFFFAOYSA-N
Molecular Formula	C7H8O2

268

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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Specifications

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

269

3-Ethynylthiophene, 96%

CAS: 67237-53-0 Molecular Formula: C₆H₄S Molecular Weight (g/mol): 108.16 InChI Key: MJHLPKWONJUCFK-UHFFFAOYSA-N Synonym: 3-ethynyl thiophene,thiophene, 3-ethynyl,3-thienylacetylene,thiophen-3-yl acetylene,3-ethynyl-thiophene,3-ethynyl thiophene;,pubchem16122,thien-3-yl acetylene,3-ethynylthiophene,ksc352m9b PubChem CID: 3548422 IUPAC Name: 3-ethynylthiophene SMILES: C#CC1=CSC=C1

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Specifications

PubChem CID	3548422
CAS	67237-53-0
Molecular Weight (g/mol)	108.16
SMILES	C#CC1=CSC=C1
Synonym	3-ethynyl thiophene,thiophene, 3-ethynyl,3-thienylacetylene,thiophen-3-yl acetylene,3-ethynyl-thiophene,3-ethynyl thiophene;,pubchem16122,thien-3-yl acetylene,3-ethynylthiophene,ksc352m9b
IUPAC Name	3-ethynylthiophene
InChI Key	MJHLPKWONJUCFK-UHFFFAOYSA-N
Molecular Formula	C₆H₄S

270

2,6-Di-tert-butylpyridine, 97%

CAS: 585-48-8 Molecular Formula: C₁₃H₂₁N Molecular Weight (g/mol): 191.32 MDL Number: MFCD00006306 InChI Key: UWKQJZCTQGMHKD-UHFFFAOYSA-N Synonym: 2,6-di-tert-butylpyridine,2,6-di tert-butyl pyridine,2,6-di-t-butylpyridine,unii-oi9lf0h4mm,2,6-di-t-butyl pyridine,pyridine, 2,6-bis 1,1-dimethylethyl,oi9lf0h4mm,2,6-di-tert-butyl pyridine,pyridine, 2,6-di-tert-butyl,pubchem16119 PubChem CID: 68510 IUPAC Name: 2,6-ditert-butylpyridine SMILES: CC(C)(C)C1=NC(=CC=C1)C(C)(C)C

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Specifications

PubChem CID	68510
CAS	585-48-8
Molecular Weight (g/mol)	191.32
MDL Number	MFCD00006306
SMILES	CC(C)(C)C1=NC(=CC=C1)C(C)(C)C
Synonym	2,6-di-tert-butylpyridine,2,6-di tert-butyl pyridine,2,6-di-t-butylpyridine,unii-oi9lf0h4mm,2,6-di-t-butyl pyridine,pyridine, 2,6-bis 1,1-dimethylethyl,oi9lf0h4mm,2,6-di-tert-butyl pyridine,pyridine, 2,6-di-tert-butyl,pubchem16119
IUPAC Name	2,6-ditert-butylpyridine
InChI Key	UWKQJZCTQGMHKD-UHFFFAOYSA-N
Molecular Formula	C₁₃H₂₁N

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