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).

346 – 360 of 76,239 results

346

Pyrazole, 98%, pure

CAS: 288-13-1 Molecular Formula: C₃H₄N₂ Molecular Weight (g/mol): 68.08 MDL Number: MFCD00005234 InChI Key: WTKZEGDFNFYCGP-UHFFFAOYSA-N Synonym: pyrazole,1,2-diazole,1h-pyrazol,pyrazol,unii-3qd5kjz7zj,3qd5kjz7zj,diazole,hpz,1-h-pyrazole,pyrazol#1 PubChem CID: 1048 ChEBI: CHEBI:17241 IUPAC Name: 1H-pyrazole SMILES: C1=CNN=C1

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Specifications

PubChem CID	1048
CAS	288-13-1
Molecular Weight (g/mol)	68.08
ChEBI	CHEBI:17241
MDL Number	MFCD00005234
SMILES	C1=CNN=C1
Synonym	pyrazole,1,2-diazole,1h-pyrazol,pyrazol,unii-3qd5kjz7zj,3qd5kjz7zj,diazole,hpz,1-h-pyrazole,pyrazol#1
IUPAC Name	1H-pyrazole
InChI Key	WTKZEGDFNFYCGP-UHFFFAOYSA-N
Molecular Formula	C₃H₄N₂

347

Ethyl isonipecotate, 98+%

CAS: 1126-09-6 Molecular Formula: C8H15NO2 Molecular Weight (g/mol): 157.21 MDL Number: MFCD00006003 InChI Key: RUJPPJYDHHAEEK-UHFFFAOYSA-N Synonym: ethyl 4-piperidinecarboxylate,ethyl isonipecotate,piperidine-4-carboxylic acid ethyl ester,ethylpiperidine-4-carboxylate,4-piperidinecarboxylic acid, ethyl ester,isonipecotic acid ethyl ester,4-piperidinecarboxylic acid ethyl ester,4-carbethoxypiperidine,4-carboethoxypiperidine,4-ethoxycarbonyl piperidine PubChem CID: 70770 IUPAC Name: ethyl piperidine-4-carboxylate SMILES: CCOC(=O)C1CCNCC1

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Specifications

PubChem CID	70770
CAS	1126-09-6
Molecular Weight (g/mol)	157.21
MDL Number	MFCD00006003
SMILES	CCOC(=O)C1CCNCC1
Synonym	ethyl 4-piperidinecarboxylate,ethyl isonipecotate,piperidine-4-carboxylic acid ethyl ester,ethylpiperidine-4-carboxylate,4-piperidinecarboxylic acid, ethyl ester,isonipecotic acid ethyl ester,4-piperidinecarboxylic acid ethyl ester,4-carbethoxypiperidine,4-carboethoxypiperidine,4-ethoxycarbonyl piperidine
IUPAC Name	ethyl piperidine-4-carboxylate
InChI Key	RUJPPJYDHHAEEK-UHFFFAOYSA-N
Molecular Formula	C8H15NO2

348

4,6-Dihydroxypyrimidine, 98%

CAS: 1193-24-4 Molecular Formula: C4H4N2O2 Molecular Weight (g/mol): 112.09 MDL Number: MFCD00016733 InChI Key: DUFGYCAXVIUXIP-UHFFFAOYSA-N Synonym: 4,6-dihydroxypyrimidine,pyrimidine-4,6-diol,4,6-pyrimidinediol,6-hydroxy-4 1h-pyrimidinone,4 1h-pyrimidinone, 6-hydroxy,4 3h-pyrimidinone, 6-hydroxy,6-hydroxypyrimidin-4 3h-one,6-hydroxy-1h-pyrimidin-4-one,4,6-dihydroxypyrimidin,6-hydroxy-4-pyrimidinone PubChem CID: 14512 SMILES: OC1=CC(=O)NC=N1

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Specifications

PubChem CID	14512
CAS	1193-24-4
Molecular Weight (g/mol)	112.09
MDL Number	MFCD00016733
SMILES	OC1=CC(=O)NC=N1
Synonym	4,6-dihydroxypyrimidine,pyrimidine-4,6-diol,4,6-pyrimidinediol,6-hydroxy-4 1h-pyrimidinone,4 1h-pyrimidinone, 6-hydroxy,4 3h-pyrimidinone, 6-hydroxy,6-hydroxypyrimidin-4 3h-one,6-hydroxy-1h-pyrimidin-4-one,4,6-dihydroxypyrimidin,6-hydroxy-4-pyrimidinone
InChI Key	DUFGYCAXVIUXIP-UHFFFAOYSA-N
Molecular Formula	C4H4N2O2

349

3-Furoic acid, 99%

CAS: 488-93-7 Molecular Formula: C5H4O3 Molecular Weight (g/mol): 112.08 MDL Number: MFCD00005350 InChI Key: IHCCAYCGZOLTEU-UHFFFAOYSA-N Synonym: 3-furoic acid,3-furancarboxylic acid,3-carboxyfuran,3-furanoic acid,unii-88a3s7rg98,3-furoate,3-furans,3-furanoate,pubchem6945,acmc-209kee PubChem CID: 10268 ChEBI: CHEBI:30846 IUPAC Name: furan-3-carboxylic acid SMILES: OC(=O)C1=COC=C1

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Specifications

PubChem CID	10268
CAS	488-93-7
Molecular Weight (g/mol)	112.08
ChEBI	CHEBI:30846
MDL Number	MFCD00005350
SMILES	OC(=O)C1=COC=C1
Synonym	3-furoic acid,3-furancarboxylic acid,3-carboxyfuran,3-furanoic acid,unii-88a3s7rg98,3-furoate,3-furans,3-furanoate,pubchem6945,acmc-209kee
IUPAC Name	furan-3-carboxylic acid
InChI Key	IHCCAYCGZOLTEU-UHFFFAOYSA-N
Molecular Formula	C5H4O3

350

6-Chloro-1,3-benzoxazol-2(3H)-one, 98+%, Thermo Scientific™

CAS: 19932-84-4 Molecular Formula: C7H4ClNO2 Molecular Weight (g/mol): 169.56 MDL Number: MFCD00463914 InChI Key: MATCZHXABVLZIE-UHFFFAOYSA-N Synonym: 6-chloro-2-benzoxazolinone,6-chlorobenzoxazolone,2 3h-benzoxazolone, 6-chloro,6-chloro-1,3-benzoxazol-2 3h-one,6-chlorobenzo d oxazol-2 3h-one,6-chlorobenzoxazolinone,6-chloro-2-benzoxazolone,6-chloro-1,3-benzoxazol-2-ol,2-benzoxazolinone, 6-chloro,6-chloro-2,3-dihydrobenzoxazol-2-one PubChem CID: 29858 IUPAC Name: 6-chloro-3H-1,3-benzoxazol-2-one SMILES: ClC1=CC=C2NC(=O)OC2=C1

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Specifications

PubChem CID	29858
CAS	19932-84-4
Molecular Weight (g/mol)	169.56
MDL Number	MFCD00463914
SMILES	ClC1=CC=C2NC(=O)OC2=C1
Synonym	6-chloro-2-benzoxazolinone,6-chlorobenzoxazolone,2 3h-benzoxazolone, 6-chloro,6-chloro-1,3-benzoxazol-2 3h-one,6-chlorobenzo d oxazol-2 3h-one,6-chlorobenzoxazolinone,6-chloro-2-benzoxazolone,6-chloro-1,3-benzoxazol-2-ol,2-benzoxazolinone, 6-chloro,6-chloro-2,3-dihydrobenzoxazol-2-one
IUPAC Name	6-chloro-3H-1,3-benzoxazol-2-one
InChI Key	MATCZHXABVLZIE-UHFFFAOYSA-N
Molecular Formula	C7H4ClNO2

351

4-(4-Chlorophenyl)-4-hydroxypiperidine, 99+%, crystalline

CAS: 39512-49-7 Molecular Formula: C11H15Cl2NO Molecular Weight (g/mol): 248.15 MDL Number: MFCD00006001 InChI Key: PXAJMBHRLGKPQV-UHFFFAOYSA-N Synonym: 4-4-chlorophenyl piperidin-4-ol,4-4-chlorophenyl-4-hydroxypiperidine,4-4-chlorophenyl-4-piperidinol,4-chlorophenyl-4-hydroxylpiperidine,4-p-chlorophenyl-4-hydroxypiperidine,4-p-chlorophenyl piperidin-4-ol,4-piperidinol, 4-4-chlorophenyl,haloperidol metabolite i,unii-und92fks0w,4-hydroxy-4-4-chlorophenyl piperidine PubChem CID: 38282 IUPAC Name: 4-(4-chlorophenyl)piperidin-4-ol SMILES: [H+].[Cl-].OC1(CCNCC1)C1=CC=C(Cl)C=C1

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Specifications

PubChem CID	38282
CAS	39512-49-7
Molecular Weight (g/mol)	248.15
MDL Number	MFCD00006001
SMILES	[H+].[Cl-].OC1(CCNCC1)C1=CC=C(Cl)C=C1
Synonym	4-4-chlorophenyl piperidin-4-ol,4-4-chlorophenyl-4-hydroxypiperidine,4-4-chlorophenyl-4-piperidinol,4-chlorophenyl-4-hydroxylpiperidine,4-p-chlorophenyl-4-hydroxypiperidine,4-p-chlorophenyl piperidin-4-ol,4-piperidinol, 4-4-chlorophenyl,haloperidol metabolite i,unii-und92fks0w,4-hydroxy-4-4-chlorophenyl piperidine
IUPAC Name	4-(4-chlorophenyl)piperidin-4-ol
InChI Key	PXAJMBHRLGKPQV-UHFFFAOYSA-N
Molecular Formula	C11H15Cl2NO

352

6-Hydroxyquinoline, 98%

CAS: 580-16-5 Molecular Formula: C₉H₇NO Molecular Weight (g/mol): 145.16 MDL Number: MFCD00047611 InChI Key: OVYWMEWYEJLIER-UHFFFAOYSA-N Synonym: 6-hydroxyquinoline,6-quinolinol,1h-1,6-epoxyquinoline,ccris 4331,6-chinolinol,6-hydroxyquinoline 6-quinolinol,quinoline-6-ol,6-quinolinoloxine,6-hydroxy-chinolin,6-hydroxy-quinoline PubChem CID: 11374 ChEBI: CHEBI:48994 IUPAC Name: quinolin-6-ol SMILES: C1=CC2=C(C=CC(=C2)O)N=C1

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Specifications

PubChem CID	11374
CAS	580-16-5
Molecular Weight (g/mol)	145.16
ChEBI	CHEBI:48994
MDL Number	MFCD00047611
SMILES	C1=CC2=C(C=CC(=C2)O)N=C1
Synonym	6-hydroxyquinoline,6-quinolinol,1h-1,6-epoxyquinoline,ccris 4331,6-chinolinol,6-hydroxyquinoline 6-quinolinol,quinoline-6-ol,6-quinolinoloxine,6-hydroxy-chinolin,6-hydroxy-quinoline
IUPAC Name	quinolin-6-ol
InChI Key	OVYWMEWYEJLIER-UHFFFAOYSA-N
Molecular Formula	C₉H₇NO

353

4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)benzoic acid, 97%

CAS: 180516-87-4 Molecular Formula: C13H17BO4 Molecular Weight (g/mol): 248.09 MDL Number: MFCD01863710 InChI Key: IYDKBQIEOBXLTP-UHFFFAOYSA-N Synonym: 4-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl benzoic acid,4-carboxyphenylboronic acid pinacol ester,4-carboxylphenylboronic acid pinacol ester,4-carboxyphenylboronic acid, pinacol ester,4-carboxyphenylboronicacidpinacolester,4-carboxybenzeneboronic acid pinacol ester,4-carboxyphenylboronic acid pinacolate,4-tetramethyl-1,3,2-dioxaborolan-2-yl benzoic acid,4-carboxyphenylboronic acid,pinacol ester,4-carboxyphenyl boronic acid, pinacol ester PubChem CID: 2734621 IUPAC Name: 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzoic acid SMILES: CC1(C)OB(OC1(C)C)C1=CC=C(C=C1)C(O)=O

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Specifications

PubChem CID	2734621
CAS	180516-87-4
Molecular Weight (g/mol)	248.09
MDL Number	MFCD01863710
SMILES	CC1(C)OB(OC1(C)C)C1=CC=C(C=C1)C(O)=O
Synonym	4-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl benzoic acid,4-carboxyphenylboronic acid pinacol ester,4-carboxylphenylboronic acid pinacol ester,4-carboxyphenylboronic acid, pinacol ester,4-carboxyphenylboronicacidpinacolester,4-carboxybenzeneboronic acid pinacol ester,4-carboxyphenylboronic acid pinacolate,4-tetramethyl-1,3,2-dioxaborolan-2-yl benzoic acid,4-carboxyphenylboronic acid,pinacol ester,4-carboxyphenyl boronic acid, pinacol ester
IUPAC Name	4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzoic acid
InChI Key	IYDKBQIEOBXLTP-UHFFFAOYSA-N
Molecular Formula	C13H17BO4

354

cis-Bis(2,2'-bipyridine)dichlororuthenium(II) hydrate, 97%

CAS: 98014-14-3 Molecular Formula: C20H16Cl2N4Ru Molecular Weight (g/mol): 484.35 MDL Number: MFCD00150005 InChI Key: MGAJEYXQYJBLQL-UHFFFAOYSA-L Synonym: cis-bis 2,2'-bipyridine dichlororuthenium ii hydrate,bis bipyridyl dichlororuthenium hydrate,2,2'-bipyridine-dichlororuthenium-water 2/1/1,cis-dichlorobis 2,2'-bipyridine ruthenium ii,cis-bis 2,2'-bipyridine dichlororuthenium ii monohydrate,cis-bis 2,2-bipyridine dichlororuthenium ii hydrate,cis-bis-2,2'-bipyridine ruthenium ii chloride,hydrate,cis-bis 2,2 inverted exclamation marka-bipyridine dichlororuthenium ii hydrate PubChem CID: 16211844 SMILES: Cl[Ru]Cl.C1=CN=C(C=C1)C1=NC=CC=C1.C1=CN=C(C=C1)C1=NC=CC=C1

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Specifications

PubChem CID	16211844
CAS	98014-14-3
Molecular Weight (g/mol)	484.35
MDL Number	MFCD00150005
SMILES	Cl[Ru]Cl.C1=CN=C(C=C1)C1=NC=CC=C1.C1=CN=C(C=C1)C1=NC=CC=C1
Synonym	cis-bis 2,2'-bipyridine dichlororuthenium ii hydrate,bis bipyridyl dichlororuthenium hydrate,2,2'-bipyridine-dichlororuthenium-water 2/1/1,cis-dichlorobis 2,2'-bipyridine ruthenium ii,cis-bis 2,2'-bipyridine dichlororuthenium ii monohydrate,cis-bis 2,2-bipyridine dichlororuthenium ii hydrate,cis-bis-2,2'-bipyridine ruthenium ii chloride,hydrate,cis-bis 2,2 inverted exclamation marka-bipyridine dichlororuthenium ii hydrate
InChI Key	MGAJEYXQYJBLQL-UHFFFAOYSA-L
Molecular Formula	C20H16Cl2N4Ru

355

3-Quinolinecarboxylic acid, 98%

CAS: 6480-68-8 Molecular Formula: C₁₀H₇NO₂ Molecular Weight (g/mol): 173.17 MDL Number: MFCD00006770 InChI Key: DJXNJVFEFSWHLY-UHFFFAOYSA-N Synonym: 3-quinolinecarboxylic acid,3-quinoline carboxylic acid,3-quinolinecarboxylicacid,pubchem7517,3-quinolylcarboxylic acid,acmc-1bfc6,3-quinolinecarboxylic acid 1g,3-quinolinecarboxylic acid, purum hplc,q3c PubChem CID: 80971 IUPAC Name: quinoline-3-carboxylic acid SMILES: C1=CC=C2C(=C1)C=C(C=N2)C(=O)O

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Specifications

PubChem CID	80971
CAS	6480-68-8
Molecular Weight (g/mol)	173.17
MDL Number	MFCD00006770
SMILES	C1=CC=C2C(=C1)C=C(C=N2)C(=O)O
Synonym	3-quinolinecarboxylic acid,3-quinoline carboxylic acid,3-quinolinecarboxylicacid,pubchem7517,3-quinolylcarboxylic acid,acmc-1bfc6,3-quinolinecarboxylic acid 1g,3-quinolinecarboxylic acid, purum hplc,q3c
IUPAC Name	quinoline-3-carboxylic acid
InChI Key	DJXNJVFEFSWHLY-UHFFFAOYSA-N
Molecular Formula	C₁₀H₇NO₂

356

2,5-Dimethylfuran, 99%

CAS: 625-86-5 Molecular Formula: C₆H₈O Molecular Weight (g/mol): 96.13 MDL Number: MFCD00003250 InChI Key: GSNUFIFRDBKVIE-UHFFFAOYSA-N Synonym: furan, 2,5-dimethyl,2,5-dimethylfurane,2,5-dimethyl-furan,2,5-dimethyl furane,unii-dr5hl9oj7y,ccris 3158,2,5-dimethyl furan,dr5hl9oj7y,2.5-dimethyl furan,acmc-1avpg PubChem CID: 12266 IUPAC Name: 2,5-dimethylfuran SMILES: CC1=CC=C(O1)C

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Specifications

PubChem CID	12266
CAS	625-86-5
Molecular Weight (g/mol)	96.13
MDL Number	MFCD00003250
SMILES	CC1=CC=C(O1)C
Synonym	furan, 2,5-dimethyl,2,5-dimethylfurane,2,5-dimethyl-furan,2,5-dimethyl furane,unii-dr5hl9oj7y,ccris 3158,2,5-dimethyl furan,dr5hl9oj7y,2.5-dimethyl furan,acmc-1avpg
IUPAC Name	2,5-dimethylfuran
InChI Key	GSNUFIFRDBKVIE-UHFFFAOYSA-N
Molecular Formula	C₆H₈O

357

4-Amino-3,5-dichloropyridine, 97%

CAS: 22889-78-7 Molecular Formula: C5H4Cl2N2 Molecular Weight (g/mol): 163.00 MDL Number: MFCD00125023 InChI Key: ISIQAMHROGZHOV-UHFFFAOYSA-N Synonym: 4-amino-3,5-dichloropyridine,3,5-dichloro-4-aminopyridine,3,5-dichloro-4-pyridinamine,4-pyridinamine, 3,5-dichloro,3,5-dichloro-4-amino pyridine,3,5-dichloro-4-pyridine amine,3,5-dichloro-pyridin-4-ylamine,3,5-dichloro-4-pyridylamine,3,5-dichloropyridin-4-ylamine,4-amino-3,5-dichloro pyridine PubChem CID: 89888 IUPAC Name: 3,5-dichloropyridin-4-amine SMILES: NC1=C(Cl)C=NC=C1Cl

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Specifications

PubChem CID	89888
CAS	22889-78-7
Molecular Weight (g/mol)	163.00
MDL Number	MFCD00125023
SMILES	NC1=C(Cl)C=NC=C1Cl
Synonym	4-amino-3,5-dichloropyridine,3,5-dichloro-4-aminopyridine,3,5-dichloro-4-pyridinamine,4-pyridinamine, 3,5-dichloro,3,5-dichloro-4-amino pyridine,3,5-dichloro-4-pyridine amine,3,5-dichloro-pyridin-4-ylamine,3,5-dichloro-4-pyridylamine,3,5-dichloropyridin-4-ylamine,4-amino-3,5-dichloro pyridine
IUPAC Name	3,5-dichloropyridin-4-amine
InChI Key	ISIQAMHROGZHOV-UHFFFAOYSA-N
Molecular Formula	C5H4Cl2N2

358

Pyridinium p-toluenesulfonate, 98%

CAS: 24057-28-1 Molecular Formula: C₁₂H₁₃NO₃S Molecular Weight (g/mol): 251.3 MDL Number: MFCD00013108 Synonym: pyridinium p-toluenesulfonate,ppts,pyridin-1-ium 4-methylbenzenesulfonate,pyridinium 4-toluenesulfonate,pyridinium tosylate,pyridinium 4-methylbenzenesulfonate,pyridinium p-toluene sulfonate,pyridinium p-toluene sulphonate,pyridinium para-toluenesulfonate,4-toluenesulfonic acid pyridine salt

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Specifications

CAS	24057-28-1
Molecular Weight (g/mol)	251.3
MDL Number	MFCD00013108
Synonym	pyridinium p-toluenesulfonate,ppts,pyridin-1-ium 4-methylbenzenesulfonate,pyridinium 4-toluenesulfonate,pyridinium tosylate,pyridinium 4-methylbenzenesulfonate,pyridinium p-toluene sulfonate,pyridinium p-toluene sulphonate,pyridinium para-toluenesulfonate,4-toluenesulfonic acid pyridine salt
Molecular Formula	C₁₂H₁₃NO₃S

359

2-Aminobenzothiazole, 97%

CAS: 136-95-8 Molecular Formula: C₇H₆N₂S Molecular Weight (g/mol): 150.2 MDL Number: MFCD00005785 InChI Key: UHGULLIUJBCTEF-UHFFFAOYSA-N Synonym: 2-aminobenzothiazole,2-benzothiazolamine,benzo d thiazol-2-amine,benzothiazol-2-ylamine,2-aminobenzthiazole,benzothiazole-2-ylamine,2-iminobenzothiazoline,o-aminobenzothiazole,benzothiazole, 2-amino,2-benzothiazolylamine PubChem CID: 8706 IUPAC Name: 1,3-benzothiazol-2-amine SMILES: C1=CC=C2C(=C1)N=C(S2)N

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Specifications

PubChem CID	8706
CAS	136-95-8
Molecular Weight (g/mol)	150.2
MDL Number	MFCD00005785
SMILES	C1=CC=C2C(=C1)N=C(S2)N
Synonym	2-aminobenzothiazole,2-benzothiazolamine,benzo d thiazol-2-amine,benzothiazol-2-ylamine,2-aminobenzthiazole,benzothiazole-2-ylamine,2-iminobenzothiazoline,o-aminobenzothiazole,benzothiazole, 2-amino,2-benzothiazolylamine
IUPAC Name	1,3-benzothiazol-2-amine
InChI Key	UHGULLIUJBCTEF-UHFFFAOYSA-N
Molecular Formula	C₇H₆N₂S

360

2-Mercaptopyridine-N-oxide, sodium salt, 40 w/w % aqueous solution

CAS: 3811-73-2 | C₅H₄NNaOS | 149.15 g/mol

Pricing & Availability
Specifications

Molecular Weight (g/mol)	149.15
CAS Min %	58.0
InChI Key	XNRNJIIJLOFJEK-UHFFFAOYSA-N
Density	1.2200g/mL
PubChem CID	19658
Name Note	40 w/w% Aqueous Solution
Percent Purity	40 to 42%
pH	8.5 to 10.5 (10% soln. at 20°C)
Formula Weight	149.15
Melting Point	-30.0°C
CAS Max %	60.0
Boiling Point	109.0°C
Physical Form	Solution
Chemical Name or Material	2-Mercaptopyridine-N-oxide, sodium salt
SMILES	C1=CC(=S)N(C=C1)[O-].[Na+]
Merck Index	10, 7892
CAS	7732-18-5
Health Hazard 3	GHS P Statement Wear protective gloves/protective clothing/eye protection/face protection. IF SWALLOWED: rinse mouth. Do NOT induce vomiting. Call a POISON CENTER or doctor/physician if you feel unwell. IF ON SKIN: Wash with plen
MDL Number	MFCD01941547
Health Hazard 2	GHS H Statement Harmful if swallowed. Harmful in contact with skin. Harmful if inhaled. Causes skin irritation. Causes serious eye irritation. Very toxic to aquatic life with long lasting effects.
Solubility Information	Solubility in water: soluble
Health Hazard 1	GHS Signal Word: Warning
Synonym	sodium omadine,sodium pyrithione,sodium 2-pyridylthio-n-oxide,pyrithione sodium salt,thione reagent,2-pyridinethiol-1-oxide sodium salt,2-mercaptopyridine n-oxide sodium salt,omadine sodium,sodium-2-pyridinethiol-1-oxide,sodium omadine van
IUPAC Name	sodium;1-oxidopyridine-2-thione
Molecular Formula	C₅H₄NNaOS
EINECS Number	223-296-5
Specific Gravity	1.22

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