Organoheterocyclic compounds

Organic compounds that consist of ring structures, or cyclic compounds that have atoms of at least two different elements as members of its ring(s).

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3,826 – 3,840 of 199,307 results

3,826

2,3-Dichloro-5-(trifluoromethyl)pyridine, 97%

CAS: 69045-84-7 Molecular Formula: C6H2Cl2F3N Molecular Weight (g/mol): 215.98 MDL Number: MFCD00042243 InChI Key: ABNQGNFVSFKJGI-UHFFFAOYSA-N Synonym: 2,3-dichloro-5-trifluoromethyl pyridine,unii-5f2c8lx8ie,2,3-dichloro-5-trifluoro methylpyridine,2,3,5-dctf,5f2c8lx8ie,2,3-dichloro-5-trifluoromethyl-pyridine,pyridine, 2,3-dichloro-5-trifluoromethyl,pubchem9237 PubChem CID: 112234 IUPAC Name: 2,3-dichloro-5-(trifluoromethyl)pyridine SMILES: FC(F)(F)C1=CN=C(Cl)C(Cl)=C1

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Specifications

PubChem CID	112234
CAS	69045-84-7
Molecular Weight (g/mol)	215.98
MDL Number	MFCD00042243
SMILES	FC(F)(F)C1=CN=C(Cl)C(Cl)=C1
Synonym	2,3-dichloro-5-trifluoromethyl pyridine,unii-5f2c8lx8ie,2,3-dichloro-5-trifluoro methylpyridine,2,3,5-dctf,5f2c8lx8ie,2,3-dichloro-5-trifluoromethyl-pyridine,pyridine, 2,3-dichloro-5-trifluoromethyl,pubchem9237
IUPAC Name	2,3-dichloro-5-(trifluoromethyl)pyridine
InChI Key	ABNQGNFVSFKJGI-UHFFFAOYSA-N
Molecular Formula	C6H2Cl2F3N

3,827

2-Chloro-6-methylnicotinic acid, 98+%

CAS: 30529-70-5 Molecular Formula: C₇H₆ClNO₂ Molecular Weight (g/mol): 171.58 MDL Number: MFCD00134165 InChI Key: ACQXHCHKMFYDPM-UHFFFAOYSA-N Synonym: 2-chloro-6-methylnicotinic acid,2-chloro-6-methyl-3-pyridinecarboxylic acid,2-chloro-6-methylnicotinicacid,6-methyl-2-chloro nicotinic acid,3-pyridinecarboxylic acid, 2-chloro-6-methyl,pubchem11019,acmc-209hgo,ksc223m1b,2-chloro-6-methyl nicotinic acid,2-chloro-6-methyl-nicotinic acid PubChem CID: 121724 IUPAC Name: 2-chloro-6-methylpyridine-3-carboxylic acid SMILES: CC1=NC(=C(C=C1)C(=O)O)Cl

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Specifications

PubChem CID	121724
CAS	30529-70-5
Molecular Weight (g/mol)	171.58
MDL Number	MFCD00134165
SMILES	CC1=NC(=C(C=C1)C(=O)O)Cl
Synonym	2-chloro-6-methylnicotinic acid,2-chloro-6-methyl-3-pyridinecarboxylic acid,2-chloro-6-methylnicotinicacid,6-methyl-2-chloro nicotinic acid,3-pyridinecarboxylic acid, 2-chloro-6-methyl,pubchem11019,acmc-209hgo,ksc223m1b,2-chloro-6-methyl nicotinic acid,2-chloro-6-methyl-nicotinic acid
IUPAC Name	2-chloro-6-methylpyridine-3-carboxylic acid
InChI Key	ACQXHCHKMFYDPM-UHFFFAOYSA-N
Molecular Formula	C₇H₆ClNO₂

3,828

Benzo[b]furan-2-carboxylic acid, 98%

CAS: 496-41-3 Molecular Formula: C9H6O3 Molecular Weight (g/mol): 162.14 MDL Number: MFCD00005848 InChI Key: OFFSPAZVIVZPHU-UHFFFAOYSA-N Synonym: benzofuran-2-carboxylic acid,coumarilic acid,benzo b furan-2-carboxylic acid,2-benzofurancarboxylic acid,2-carboxybenzofuran,coumarone-2-carboxylic acid,unii-7z6nmg947l,chembl84095,benzofuran-2-carboxylicacid PubChem CID: 10331 IUPAC Name: 1-benzofuran-2-carboxylic acid SMILES: OC(=O)C1=CC2=CC=CC=C2O1

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Specifications

PubChem CID	10331
CAS	496-41-3
Molecular Weight (g/mol)	162.14
MDL Number	MFCD00005848
SMILES	OC(=O)C1=CC2=CC=CC=C2O1
Synonym	benzofuran-2-carboxylic acid,coumarilic acid,benzo b furan-2-carboxylic acid,2-benzofurancarboxylic acid,2-carboxybenzofuran,coumarone-2-carboxylic acid,unii-7z6nmg947l,chembl84095,benzofuran-2-carboxylicacid
IUPAC Name	1-benzofuran-2-carboxylic acid
InChI Key	OFFSPAZVIVZPHU-UHFFFAOYSA-N
Molecular Formula	C9H6O3

3,829

Theobromine, 99%

CAS: 83-67-0 Molecular Formula: C₇H₈N₄O₂ Molecular Weight (g/mol): 180.17 MDL Number: MFCD00022830 InChI Key: YAPQBXQYLJRXSA-UHFFFAOYSA-N Synonym: theobromine,3,7-dimethylxanthine,diurobromine,teobromin,theosalvose,theostene,santheose,thesodate,thesal,theobromin PubChem CID: 5429 ChEBI: CHEBI:28946 IUPAC Name: 3,7-dimethylpurine-2,6-dione SMILES: CN1C=NC2=C1C(=O)NC(=O)N2C

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Specifications

PubChem CID	5429
CAS	83-67-0
Molecular Weight (g/mol)	180.17
ChEBI	CHEBI:28946
MDL Number	MFCD00022830
SMILES	CN1C=NC2=C1C(=O)NC(=O)N2C
Synonym	theobromine,3,7-dimethylxanthine,diurobromine,teobromin,theosalvose,theostene,santheose,thesodate,thesal,theobromin
IUPAC Name	3,7-dimethylpurine-2,6-dione
InChI Key	YAPQBXQYLJRXSA-UHFFFAOYSA-N
Molecular Formula	C₇H₈N₄O₂

3,830

9-Methyladenine, 98%, Thermo Scientific Chemicals

CAS: 700-00-5 Molecular Formula: C6H7N5 Molecular Weight (g/mol): 149.16 MDL Number: MFCD00047232 InChI Key: WRXCXOUDSPTXNX-UHFFFAOYSA-N Synonym: 9-methyladenine,9-methyl-9h-purin-6-amine,n9-methyladenine,9-methyl-9h-adenine,6-amino-9-methylpurine,9h-purin-6-amine, 9-methyl,adenine, 9-methyl,9-methyl-9h-purin-6-ylamine,ccris 6905,chembl65976 PubChem CID: 69689 ChEBI: CHEBI:40526 IUPAC Name: 9-methylpurin-6-amine SMILES: CN1C=NC2=C(N)N=CN=C12

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Specifications

PubChem CID	69689
CAS	700-00-5
Molecular Weight (g/mol)	149.16
ChEBI	CHEBI:40526
MDL Number	MFCD00047232
SMILES	CN1C=NC2=C(N)N=CN=C12
Synonym	9-methyladenine,9-methyl-9h-purin-6-amine,n9-methyladenine,9-methyl-9h-adenine,6-amino-9-methylpurine,9h-purin-6-amine, 9-methyl,adenine, 9-methyl,9-methyl-9h-purin-6-ylamine,ccris 6905,chembl65976
IUPAC Name	9-methylpurin-6-amine
InChI Key	WRXCXOUDSPTXNX-UHFFFAOYSA-N
Molecular Formula	C6H7N5

3,831

Azetidine, 98%

CAS: 503-29-7 Molecular Formula: C₃H₇N Molecular Weight (g/mol): 57.09 InChI Key: HONIICLYMWZJFZ-UHFFFAOYSA-N Synonym: azacyclobutane,trimethylene imine,1,3-propylenimine,trimethylenimine,azetidin,unii-37s883xdwr,azetidine, l,polypropylene amine,azete, tetrahydro,azetidine PubChem CID: 10422 ChEBI: CHEBI:30968 IUPAC Name: azetidine SMILES: C1CNC1

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Specifications

PubChem CID	10422
CAS	503-29-7
Molecular Weight (g/mol)	57.09
ChEBI	CHEBI:30968
SMILES	C1CNC1
Synonym	azacyclobutane,trimethylene imine,1,3-propylenimine,trimethylenimine,azetidin,unii-37s883xdwr,azetidine, l,polypropylene amine,azete, tetrahydro,azetidine
IUPAC Name	azetidine
InChI Key	HONIICLYMWZJFZ-UHFFFAOYSA-N
Molecular Formula	C₃H₇N

3,832

3,4-Methylenedioxyacetophenone, 98%

CAS: 3162-29-6 Molecular Formula: C₉H₈O₃ Molecular Weight (g/mol): 164.16 MDL Number: MFCD00005831 InChI Key: BMHMKWXYXFBWMI-UHFFFAOYSA-N Synonym: 3',4'-methylenedioxy acetophenone,1-benzo d 1,3 dioxol-5-yl ethanone,5-acetyl-1,3-benzodioxole,3,4-methylenedioxyacetophenone,3,4-methylenedioxy acetophenone,3',4'-methylenedioxyacetophenone,1-1,3-benzodioxol-5-yl ethanone,acetopiperone,1-1,3-benzodioxol-5-yl ethan-1-one,ethanone, 1-1,3-benzodioxol-5-yl PubChem CID: 76622 IUPAC Name: 1-(1,3-benzodioxol-5-yl)ethanone SMILES: CC(=O)C1=CC2=C(C=C1)OCO2

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Specifications

PubChem CID	76622
CAS	3162-29-6
Molecular Weight (g/mol)	164.16
MDL Number	MFCD00005831
SMILES	CC(=O)C1=CC2=C(C=C1)OCO2
Synonym	3',4'-methylenedioxy acetophenone,1-benzo d 1,3 dioxol-5-yl ethanone,5-acetyl-1,3-benzodioxole,3,4-methylenedioxyacetophenone,3,4-methylenedioxy acetophenone,3',4'-methylenedioxyacetophenone,1-1,3-benzodioxol-5-yl ethanone,acetopiperone,1-1,3-benzodioxol-5-yl ethan-1-one,ethanone, 1-1,3-benzodioxol-5-yl
IUPAC Name	1-(1,3-benzodioxol-5-yl)ethanone
InChI Key	BMHMKWXYXFBWMI-UHFFFAOYSA-N
Molecular Formula	C₉H₈O₃

3,833

Indole-3-carboxylic acid, 99%

CAS: 771-50-6 Molecular Formula: C₉H₇NO₂ Molecular Weight (g/mol): 161.16 MDL Number: MFCD00005624 InChI Key: KMAKOBLIOCQGJP-UHFFFAOYSA-N Synonym: indole-3-carboxylic acid,3-indoleformic acid,3-carboxyindole,indole-3-carboxylicacid,3-indolecarboxylic acid,indole-3-carboxylate,3-indolylcarboxylic acid,beta-indolylcarboxylic acid,indole-3 carboxylic acid,ico PubChem CID: 69867 ChEBI: CHEBI:24809 IUPAC Name: 1H-indole-3-carboxylic acid SMILES: C1=CC=C2C(=C1)C(=CN2)C(=O)O

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Specifications

PubChem CID	69867
CAS	771-50-6
Molecular Weight (g/mol)	161.16
ChEBI	CHEBI:24809
MDL Number	MFCD00005624
SMILES	C1=CC=C2C(=C1)C(=CN2)C(=O)O
Synonym	indole-3-carboxylic acid,3-indoleformic acid,3-carboxyindole,indole-3-carboxylicacid,3-indolecarboxylic acid,indole-3-carboxylate,3-indolylcarboxylic acid,beta-indolylcarboxylic acid,indole-3 carboxylic acid,ico
IUPAC Name	1H-indole-3-carboxylic acid
InChI Key	KMAKOBLIOCQGJP-UHFFFAOYSA-N
Molecular Formula	C₉H₇NO₂

3,834

Thermo Scientific Chemicals Diltiazem hydrochloride, 98%

CAS: 33286-22-5 Molecular Formula: C₂₂H₂₆N₂O₄S·HCl Molecular Weight (g/mol): 450.99 MDL Number: MFCD00069252 InChI Key: HDRXZJPWHTXQRI-BHDTVMLSSA-N Synonym: diltiazem hydrochloride,diltiazem hcl,herbesser,dilzene,lacerol,masdil,tildiem,tiazac,mono-tildiem,bi-tildiem PubChem CID: 62920 ChEBI: CHEBI:645509 IUPAC Name: [(2S,3S)-5-[2-(dimethylamino)ethyl]-2-(4-methoxyphenyl)-4-oxo-2,3-dihydro-1,5-benzothiazepin-3-yl] acetate;hydrochloride SMILES: CC(=O)OC1C(SC2=CC=CC=C2N(C1=O)CCN(C)C)C3=CC=C(C=C3)OC.Cl

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Specifications

PubChem CID	62920
CAS	33286-22-5
Molecular Weight (g/mol)	450.99
ChEBI	CHEBI:645509
MDL Number	MFCD00069252
SMILES	CC(=O)OC1C(SC2=CC=CC=C2N(C1=O)CCN(C)C)C3=CC=C(C=C3)OC.Cl
Synonym	diltiazem hydrochloride,diltiazem hcl,herbesser,dilzene,lacerol,masdil,tildiem,tiazac,mono-tildiem,bi-tildiem
IUPAC Name	[(2S,3S)-5-[2-(dimethylamino)ethyl]-2-(4-methoxyphenyl)-4-oxo-2,3-dihydro-1,5-benzothiazepin-3-yl] acetate;hydrochloride
InChI Key	HDRXZJPWHTXQRI-BHDTVMLSSA-N
Molecular Formula	C₂₂H₂₆N₂O₄S·HCl

3,835

5-Methyl-2-furanmethanol, 97%

CAS: 3857-25-8 Molecular Formula: C₆H₈O₂ Molecular Weight (g/mol): 112.13 InChI Key: VOZFDEJGHQWZHU-UHFFFAOYSA-N Synonym: 5-methylfuran-2-yl methanol,5-methyl-2-furanmethanol,5-methylfurfuryl alcohol,5-methyl-2-furyl methanol,2-furanmethanol, 5-methyl,unii-0jvo5efa0a,0jvo5efa0a,pubchem9804,5-methyl furfuryl alcohol,5-methylfuran-2-methanol PubChem CID: 520911 IUPAC Name: (5-methylfuran-2-yl)methanol SMILES: CC1=CC=C(O1)CO

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Specifications

PubChem CID	520911
CAS	3857-25-8
Molecular Weight (g/mol)	112.13
SMILES	CC1=CC=C(O1)CO
Synonym	5-methylfuran-2-yl methanol,5-methyl-2-furanmethanol,5-methylfurfuryl alcohol,5-methyl-2-furyl methanol,2-furanmethanol, 5-methyl,unii-0jvo5efa0a,0jvo5efa0a,pubchem9804,5-methyl furfuryl alcohol,5-methylfuran-2-methanol
IUPAC Name	(5-methylfuran-2-yl)methanol
InChI Key	VOZFDEJGHQWZHU-UHFFFAOYSA-N
Molecular Formula	C₆H₈O₂

3,836

3-Hexylthiophene, 98%

CAS: 1693-86-3 Molecular Formula: C₁₀H₁₆S Molecular Weight (g/mol): 168.3 MDL Number: MFCD00143181 InChI Key: JEDHEMYZURJGRQ-UHFFFAOYSA-N Synonym: 3-n-hexylthiophene,thiophene, 3-hexyl,3-hexylthiopene,3-hexylthiophen,4-hexylthiophene,hexylthiophene 3-,pubchem8861,poly,3-hexylthiophene,3-hexylthiophene, 97+% PubChem CID: 566849 IUPAC Name: 3-hexylthiophene SMILES: CCCCCCC1=CSC=C1

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Specifications

PubChem CID	566849
CAS	1693-86-3
Molecular Weight (g/mol)	168.3
MDL Number	MFCD00143181
SMILES	CCCCCCC1=CSC=C1
Synonym	3-n-hexylthiophene,thiophene, 3-hexyl,3-hexylthiopene,3-hexylthiophen,4-hexylthiophene,hexylthiophene 3-,pubchem8861,poly,3-hexylthiophene,3-hexylthiophene, 97+%
IUPAC Name	3-hexylthiophene
InChI Key	JEDHEMYZURJGRQ-UHFFFAOYSA-N
Molecular Formula	C₁₀H₁₆S

3,837

2-Chloro-4-picoline, 98%

CAS: 3678-62-4 Molecular Formula: C₆H₆ClN Molecular Weight (g/mol): 127.57 MDL Number: MFCD00023418 InChI Key: MZVSTDHRRYQFGI-UHFFFAOYSA-N Synonym: 2-chloro-4-picoline,pyridine, 2-chloro-4-methyl,2-chloro-4-methyl-pyridine,2-chloro-4-methyl pyridine,2-chloro-gamma-picoline,4-picoline, 2-chloro,zlchem 438,pubchem1192,acmc-209iop PubChem CID: 77248 IUPAC Name: 2-chloro-4-methylpyridine SMILES: CC1=CC(=NC=C1)Cl

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Specifications

PubChem CID	77248
CAS	3678-62-4
Molecular Weight (g/mol)	127.57
MDL Number	MFCD00023418
SMILES	CC1=CC(=NC=C1)Cl
Synonym	2-chloro-4-picoline,pyridine, 2-chloro-4-methyl,2-chloro-4-methyl-pyridine,2-chloro-4-methyl pyridine,2-chloro-gamma-picoline,4-picoline, 2-chloro,zlchem 438,pubchem1192,acmc-209iop
IUPAC Name	2-chloro-4-methylpyridine
InChI Key	MZVSTDHRRYQFGI-UHFFFAOYSA-N
Molecular Formula	C₆H₆ClN

3,838

2-chloro-3-picoline, 98%, Thermo Scientific™

CAS: 18368-76-8 Molecular Formula: C₆H₆ClN Molecular Weight (g/mol): 127.57 MDL Number: MFCD00234177 InChI Key: RKVUCIFREKHYTL-UHFFFAOYSA-N PubChem CID: 87603 IUPAC Name: 2-chloro-3-methylpyridine SMILES: CC1=C(N=CC=C1)Cl

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Specifications

PubChem CID	87603
CAS	18368-76-8
Molecular Weight (g/mol)	127.57
MDL Number	MFCD00234177
SMILES	CC1=C(N=CC=C1)Cl
IUPAC Name	2-chloro-3-methylpyridine
InChI Key	RKVUCIFREKHYTL-UHFFFAOYSA-N
Molecular Formula	C₆H₆ClN

3,839

6-Hydroxyindole, 97%

CAS: 2380-86-1 Molecular Formula: C₈H₇NO Molecular Weight (g/mol): 133.15 InChI Key: XAWPKHNOFIWWNZ-UHFFFAOYSA-N Synonym: 6-hydroxyindole,6-indolol,indolol,6-hydroxy indole,unii-3i03jz599t,6-hydroxy-1h-indole,6hydroxyindole,6-hydroxy-indole,indol-6-ol,1h-indole-6-ol PubChem CID: 524508 IUPAC Name: 1H-indol-6-ol SMILES: C1=CC(=CC2=C1C=CN2)O

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Specifications

PubChem CID	524508
CAS	2380-86-1
Molecular Weight (g/mol)	133.15
SMILES	C1=CC(=CC2=C1C=CN2)O
Synonym	6-hydroxyindole,6-indolol,indolol,6-hydroxy indole,unii-3i03jz599t,6-hydroxy-1h-indole,6hydroxyindole,6-hydroxy-indole,indol-6-ol,1h-indole-6-ol
IUPAC Name	1H-indol-6-ol
InChI Key	XAWPKHNOFIWWNZ-UHFFFAOYSA-N
Molecular Formula	C₈H₇NO

3,840

1-Chloroisoquinoline, 97+%

CAS: 19493-44-8 Molecular Formula: C₉H₆ClN Molecular Weight (g/mol): 163.61 MDL Number: MFCD00024134 InChI Key: MSQCQINLJMEVNJ-UHFFFAOYSA-N Synonym: 1-chloro-isoquinoline,isoquinoline, 1-chloro,chloroisoquinoline,isoquinoline, chloro,1-chloroisoquinone,1-chloro isoquinoline,zlchem 1129,pubchem13906,acmc-1bowu,1-chloroisoquinoline PubChem CID: 140539 IUPAC Name: 1-chloroisoquinoline SMILES: C1=CC=C2C(=C1)C=CN=C2Cl

Pricing & Availability
Specifications

PubChem CID	140539
CAS	19493-44-8
Molecular Weight (g/mol)	163.61
MDL Number	MFCD00024134
SMILES	C1=CC=C2C(=C1)C=CN=C2Cl
Synonym	1-chloro-isoquinoline,isoquinoline, 1-chloro,chloroisoquinoline,isoquinoline, chloro,1-chloroisoquinone,1-chloro isoquinoline,zlchem 1129,pubchem13906,acmc-1bowu,1-chloroisoquinoline
IUPAC Name	1-chloroisoquinoline
InChI Key	MSQCQINLJMEVNJ-UHFFFAOYSA-N
Molecular Formula	C₉H₆ClN

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