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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Imidazole (Certified), Fisher Chemical

CAS: 288-32-4 Molecular Formula: C3H4N2 Molecular Weight (g/mol): 68.08 MDL Number: MFCD00005183 InChI Key: RAXXELZNTBOGNW-UHFFFAOYSA-N Synonym: imidazole,glyoxaline,imidazol,iminazole,miazole,1,3-diazole,glyoxalin,imutex,1,3-diaza-2,4-cyclopentadiene,pyrro b monazole PubChem CID: 795 ChEBI: CHEBI:16069 IUPAC Name: 1H-imidazole SMILES: N1C=CN=C1

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PubChem CID	795
CAS	288-32-4
Molecular Weight (g/mol)	68.08
ChEBI	CHEBI:16069
MDL Number	MFCD00005183
SMILES	N1C=CN=C1
Synonym	imidazole,glyoxaline,imidazol,iminazole,miazole,1,3-diazole,glyoxalin,imutex,1,3-diaza-2,4-cyclopentadiene,pyrro b monazole
IUPAC Name	1H-imidazole
InChI Key	RAXXELZNTBOGNW-UHFFFAOYSA-N
Molecular Formula	C3H4N2

Imidazole (Molecular Biology), Fisher BioReagents™,50g

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Specifications

PubChem CID	795
CAS	288-32-4
Molecular Weight (g/mol)	68.08
ChEBI	CHEBI:16069
MDL Number	MFCD00005183
SMILES	N1C=CN=C1
Synonym	imidazole,glyoxaline,imidazol,iminazole,miazole,1,3-diazole,glyoxalin,imutex,1,3-diaza-2,4-cyclopentadiene,pyrro b monazole
IUPAC Name	1H-imidazole
InChI Key	RAXXELZNTBOGNW-UHFFFAOYSA-N
Molecular Formula	C3H4N2

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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Specifications

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

2-(2-Thienyl)ethanol, 98%

CAS: 5402-55-1 Molecular Formula: C6H8OS Molecular Weight (g/mol): 128.19 MDL Number: MFCD00005462 InChI Key: VMJOFTHFJMLIKL-UHFFFAOYSA-N Synonym: 2-thiopheneethanol,2-2-thienyl ethanol,thiophene-2-ethanol,2-thiophen-2-yl ethanol,2-2-hydroxyethyl thiophene,2-thiophen-2-yl ethan-1-ol,ethanol, 2-2-thienyl,2-thiophenethanol,2-2-thienyl-ethanol,2-thienylethanol PubChem CID: 79400 IUPAC Name: 2-thiophen-2-ylethanol SMILES: OCCC1=CC=CS1

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Specifications

PubChem CID	79400
CAS	5402-55-1
Molecular Weight (g/mol)	128.19
MDL Number	MFCD00005462
SMILES	OCCC1=CC=CS1
Synonym	2-thiopheneethanol,2-2-thienyl ethanol,thiophene-2-ethanol,2-thiophen-2-yl ethanol,2-2-hydroxyethyl thiophene,2-thiophen-2-yl ethan-1-ol,ethanol, 2-2-thienyl,2-thiophenethanol,2-2-thienyl-ethanol,2-thienylethanol
IUPAC Name	2-thiophen-2-ylethanol
InChI Key	VMJOFTHFJMLIKL-UHFFFAOYSA-N
Molecular Formula	C6H8OS

2-Methyl-3-(2-furyl)propenal, 97%

CAS: 874-66-8 Molecular Formula: C8H8O2 Molecular Weight (g/mol): 136.15 MDL Number: MFCD00063240 InChI Key: ZNBXZUKDRRRQJK-FNORWQNLSA-N Synonym: 2-methyl-3-2-furyl propenal,alpha-methylfurylacrolein,2-methyl-3-2-furyl acrolein,furfurylidene-2-propanal,furfurylidine-2-propanal,2-methyl-3-furylacrolein,alpha-methyl-2-furanacrolein,2-furfurylidenepropionaldehyde,3-2-furyl methacrylaldehyde,2-methyl-3 2-furyl acrolein PubChem CID: 6210220 IUPAC Name: (E)-3-(furan-2-yl)-2-methylprop-2-enal SMILES: CC(=CC1=CC=CO1)C=O

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Specifications

PubChem CID	6210220
CAS	874-66-8
Molecular Weight (g/mol)	136.15
MDL Number	MFCD00063240
SMILES	CC(=CC1=CC=CO1)C=O
Synonym	2-methyl-3-2-furyl propenal,alpha-methylfurylacrolein,2-methyl-3-2-furyl acrolein,furfurylidene-2-propanal,furfurylidine-2-propanal,2-methyl-3-furylacrolein,alpha-methyl-2-furanacrolein,2-furfurylidenepropionaldehyde,3-2-furyl methacrylaldehyde,2-methyl-3 2-furyl acrolein
IUPAC Name	(E)-3-(furan-2-yl)-2-methylprop-2-enal
InChI Key	ZNBXZUKDRRRQJK-FNORWQNLSA-N
Molecular Formula	C8H8O2

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

2-Furaldehyde 2,2-dimethylhydrazone, 98%

CAS: 14064-21-2 Molecular Formula: C7H10N2O Molecular Weight (g/mol): 138.17 MDL Number: MFCD00010685,MFCD00010685 InChI Key: DURWBNUASAZMSN-SOFGYWHQSA-N Synonym: e-2-furan-2-ylmethylidene-1,1-dimethylhydrazine,furfural dimethyl hydrazone PubChem CID: 5372420 SMILES: CN(C)\N=C\C1=CC=CO1

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Specifications

PubChem CID	5372420
CAS	14064-21-2
Molecular Weight (g/mol)	138.17
MDL Number	MFCD00010685,MFCD00010685
SMILES	CN(C)\N=C\C1=CC=CO1
Synonym	e-2-furan-2-ylmethylidene-1,1-dimethylhydrazine,furfural dimethyl hydrazone
InChI Key	DURWBNUASAZMSN-SOFGYWHQSA-N
Molecular Formula	C7H10N2O

4-Pyridineacetonitrile, ≥97%, Thermo Scientific Chemicals

CAS: 13121-99-8 Molecular Formula: C7H6N2 Molecular Weight (g/mol): 118.14 MDL Number: MFCD03412601 InChI Key: BMVSAKPRNWZCPG-UHFFFAOYSA-N Synonym: pyridin-4-yl-acetonitrile,2-pyridin-4-yl acetonitrile,4-pyridylacetonitrile,4-pyridineacetonitrile,pyridin-4-ylacetonitrile,pyridine-4-acetonitrile,rarechem ak ml 0204,2-4-pyridyl acetonitrile,4-pyridylacetonitrilehydrochloride,4-cyanomethyl-pyridine PubChem CID: 4112085 IUPAC Name: 2-pyridin-4-ylacetonitrile SMILES: N#CCC1=CC=NC=C1

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Specifications

PubChem CID	4112085
CAS	13121-99-8
Molecular Weight (g/mol)	118.14
MDL Number	MFCD03412601
SMILES	N#CCC1=CC=NC=C1
Synonym	pyridin-4-yl-acetonitrile,2-pyridin-4-yl acetonitrile,4-pyridylacetonitrile,4-pyridineacetonitrile,pyridin-4-ylacetonitrile,pyridine-4-acetonitrile,rarechem ak ml 0204,2-4-pyridyl acetonitrile,4-pyridylacetonitrilehydrochloride,4-cyanomethyl-pyridine
IUPAC Name	2-pyridin-4-ylacetonitrile
InChI Key	BMVSAKPRNWZCPG-UHFFFAOYSA-N
Molecular Formula	C7H6N2

Isoquinoline, 97%

CAS: 119-65-3 Molecular Formula: C9H7N Molecular Weight (g/mol): 129.16 MDL Number: MFCD00006898,MFCD31699977 InChI Key: AWJUIBRHMBBTKR-UHFFFAOYSA-N Synonym: 2-azanaphthalene,2-benzazine,isochinolin,benzo c pyridine,beta-quinoline,2-benzanine,3,4-benzopyridine,.beta.-quinoline,isochinolin czech PubChem CID: 8405 ChEBI: CHEBI:16092 IUPAC Name: isoquinoline SMILES: C1=CC=C2C=NC=CC2=C1

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Specifications

PubChem CID	8405
CAS	119-65-3
Molecular Weight (g/mol)	129.16
ChEBI	CHEBI:16092
MDL Number	MFCD00006898,MFCD31699977
SMILES	C1=CC=C2C=NC=CC2=C1
Synonym	2-azanaphthalene,2-benzazine,isochinolin,benzo c pyridine,beta-quinoline,2-benzanine,3,4-benzopyridine,.beta.-quinoline,isochinolin czech
IUPAC Name	isoquinoline
InChI Key	AWJUIBRHMBBTKR-UHFFFAOYSA-N
Molecular Formula	C9H7N

2,4,6-Tris(3-pyridyl)-1,3,5-triazine, 97%

CAS: 42333-76-6 Molecular Formula: C18H12N6 Molecular Weight (g/mol): 312.34 MDL Number: MFCD23379843 InChI Key: UOSYDSDIRAXTTF-UHFFFAOYSA-N Synonym: 2,4,6-tris 3-pyridyl-s-triazine,2,4,6-tri-3-pyridinyl-1,3,5-triazine,tris pyridin-3-yl-1,3,5-triazine,2,4,6-tris 3-pyridyl-1,3,5-triazine PubChem CID: 11472427 IUPAC Name: 2,4,6-tripyridin-3-yl-1,3,5-triazine SMILES: C1=CC(=CN=C1)C1=NC(=NC(=N1)C1=CN=CC=C1)C1=CN=CC=C1

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Specifications

PubChem CID	11472427
CAS	42333-76-6
Molecular Weight (g/mol)	312.34
MDL Number	MFCD23379843
SMILES	C1=CC(=CN=C1)C1=NC(=NC(=N1)C1=CN=CC=C1)C1=CN=CC=C1
Synonym	2,4,6-tris 3-pyridyl-s-triazine,2,4,6-tri-3-pyridinyl-1,3,5-triazine,tris pyridin-3-yl-1,3,5-triazine,2,4,6-tris 3-pyridyl-1,3,5-triazine
IUPAC Name	2,4,6-tripyridin-3-yl-1,3,5-triazine
InChI Key	UOSYDSDIRAXTTF-UHFFFAOYSA-N
Molecular Formula	C18H12N6

2-Amino-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carbonitrile, 97%

CAS: 4651-91-6 Molecular Formula: C9H10N2S Molecular Weight (g/mol): 178.253 MDL Number: MFCD00128278 InChI Key: ADHVMGAFAKSNOM-UHFFFAOYSA-N Synonym: 2-amino-4,5,6,7-tetrahydrobenzo b thiophene-3-carbonitrile,2-amino-3-cyano-4,5,6,7-tetrahydrobenzo b thiophene,2-amino-4,5,6,7-tetrahydro-benzo b thiophene-3-carbonitrile,benzo b thiophene-3-carbonitrile, 2-amino-4,5,6,7-tetrahydro,2-amino-4,5,6,7-tetrahydro-1-benzo b thiophene-3-carbonitrile,2-amino-4,5,6,7-tetrahydrobenzo b thiophene-3-carbonitryle,cambridge id 5130181,aminotetrahydrobenzothiophenecarbonitrile PubChem CID: 78382 IUPAC Name: 2-amino-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile SMILES: C1CCC2=C(C1)C(=C(S2)N)C#N

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Specifications

PubChem CID	78382
CAS	4651-91-6
Molecular Weight (g/mol)	178.253
MDL Number	MFCD00128278
SMILES	C1CCC2=C(C1)C(=C(S2)N)C#N
Synonym	2-amino-4,5,6,7-tetrahydrobenzo b thiophene-3-carbonitrile,2-amino-3-cyano-4,5,6,7-tetrahydrobenzo b thiophene,2-amino-4,5,6,7-tetrahydro-benzo b thiophene-3-carbonitrile,benzo b thiophene-3-carbonitrile, 2-amino-4,5,6,7-tetrahydro,2-amino-4,5,6,7-tetrahydro-1-benzo b thiophene-3-carbonitrile,2-amino-4,5,6,7-tetrahydrobenzo b thiophene-3-carbonitryle,cambridge id 5130181,aminotetrahydrobenzothiophenecarbonitrile
IUPAC Name	2-amino-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile
InChI Key	ADHVMGAFAKSNOM-UHFFFAOYSA-N
Molecular Formula	C9H10N2S

PubChem CID	795
CAS	288-32-4
Molecular Weight (g/mol)	68.08
ChEBI	CHEBI:16069
MDL Number	MFCD00005183
SMILES	N1C=CN=C1
Synonym	imidazole,glyoxaline,imidazol,iminazole,miazole,1,3-diazole,glyoxalin,imutex,1,3-diaza-2,4-cyclopentadiene,pyrro b monazole
IUPAC Name	1H-imidazole
InChI Key	RAXXELZNTBOGNW-UHFFFAOYSA-N
Molecular Formula	C3H4N2

1-Methylpyrrole, 99%

CAS: 96-54-8 Molecular Formula: C5H7N Molecular Weight (g/mol): 81.118 MDL Number: MFCD00005345 InChI Key: OXHNLMTVIGZXSG-UHFFFAOYSA-N Synonym: 1-methyl-1h-pyrrole,n-methylpyrrole,n-methyl pyrrole,1h-pyrrole, 1-methyl,pyrrole, 1-methyl,methylpyrrole,n-methylpyrrol,1-methylpyrrol,unii-ng5gpn98zg,ccris 2934 PubChem CID: 7304 IUPAC Name: 1-methylpyrrole SMILES: CN1C=CC=C1

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Specifications

PubChem CID	7304
CAS	96-54-8
Molecular Weight (g/mol)	81.118
MDL Number	MFCD00005345
SMILES	CN1C=CC=C1
Synonym	1-methyl-1h-pyrrole,n-methylpyrrole,n-methyl pyrrole,1h-pyrrole, 1-methyl,pyrrole, 1-methyl,methylpyrrole,n-methylpyrrol,1-methylpyrrol,unii-ng5gpn98zg,ccris 2934
IUPAC Name	1-methylpyrrole
InChI Key	OXHNLMTVIGZXSG-UHFFFAOYSA-N
Molecular Formula	C5H7N

2-n-Octylthiophene, 98%

CAS: 880-36-4 Molecular Formula: C12H20S Molecular Weight (g/mol): 196.352 MDL Number: MFCD00041015 InChI Key: GIFWAJGKWIDXMY-UHFFFAOYSA-N Synonym: 2-n-octylthiophene,thiophene, 2-octyl,octylthiophene,acmc-209qqw PubChem CID: 70153 IUPAC Name: 2-octylthiophene SMILES: CCCCCCCCC1=CC=CS1

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Specifications

PubChem CID	70153
CAS	880-36-4
Molecular Weight (g/mol)	196.352
MDL Number	MFCD00041015
SMILES	CCCCCCCCC1=CC=CS1
Synonym	2-n-octylthiophene,thiophene, 2-octyl,octylthiophene,acmc-209qqw
IUPAC Name	2-octylthiophene
InChI Key	GIFWAJGKWIDXMY-UHFFFAOYSA-N
Molecular Formula	C12H20S

Furan-2-boronic acid, 97%

CAS: 13331-23-2 Molecular Formula: C4H5BO3 Molecular Weight (g/mol): 111.891 MDL Number: MFCD00799544 InChI Key: PZJSZBJLOWMDRG-UHFFFAOYSA-N Synonym: 2-furanboronic acid,furan-2-boronic acid,2-furylboronic acid,2-furanylboronic acid,furan-2-ylboranediol,furan 2-boronic acid,2-furan boronic acid,furan-2-yl boronic acid,boronic acid, furanyl,2furylboronic acid PubChem CID: 2734357 IUPAC Name: furan-2-ylboronic acid SMILES: B(C1=CC=CO1)(O)O

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Specifications

PubChem CID	2734357
CAS	13331-23-2
Molecular Weight (g/mol)	111.891
MDL Number	MFCD00799544
SMILES	B(C1=CC=CO1)(O)O
Synonym	2-furanboronic acid,furan-2-boronic acid,2-furylboronic acid,2-furanylboronic acid,furan-2-ylboranediol,furan 2-boronic acid,2-furan boronic acid,furan-2-yl boronic acid,boronic acid, furanyl,2furylboronic acid
IUPAC Name	furan-2-ylboronic acid
InChI Key	PZJSZBJLOWMDRG-UHFFFAOYSA-N
Molecular Formula	C4H5BO3

Heteroaromatic compounds

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