Imidazoles

Aromatic organic heterocyclic compounds that consist of a diazole with non-adjacent nitrogen atoms with the formula: C3N2H4.

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4-Nitroimidazole, 98%

CAS: 3034-38-6 Molecular Formula: C3H3N3O2 Molecular Weight (g/mol): 113.08 MDL Number: MFCD00005196 InChI Key: VYDWQPKRHOGLPA-UHFFFAOYSA-N Synonym: 4-nitroimidazole,4-nitro-1h-imidazole,1h-imidazole, 4-nitro,5-nitroimidazole,4 5-nitroimidazole,imidazole, 4-nitro,1h-imidazole, 5-nitro,unii-y8u32az5o7,5 4-nitroimidazole,4-nitro-3h-imidazole PubChem CID: 18208 ChEBI: CHEBI:64635 IUPAC Name: 5-nitro-1H-imidazole SMILES: [O-][N+](=O)C1=CN=CN1

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Specifications

PubChem CID	18208
CAS	3034-38-6
Molecular Weight (g/mol)	113.08
ChEBI	CHEBI:64635
MDL Number	MFCD00005196
SMILES	[O-][N+](=O)C1=CN=CN1
Synonym	4-nitroimidazole,4-nitro-1h-imidazole,1h-imidazole, 4-nitro,5-nitroimidazole,4 5-nitroimidazole,imidazole, 4-nitro,1h-imidazole, 5-nitro,unii-y8u32az5o7,5 4-nitroimidazole,4-nitro-3h-imidazole
IUPAC Name	5-nitro-1H-imidazole
InChI Key	VYDWQPKRHOGLPA-UHFFFAOYSA-N
Molecular Formula	C3H3N3O2

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1-n-Butyl-2,3-dimethylimidazolium tetrafluoroborate, 99%

CAS: 402846-78-0 Molecular Formula: C9H17BF4N2 Molecular Weight (g/mol): 240.05 MDL Number: MFCD03427618 InChI Key: VCAIYEJBOWHUGP-UHFFFAOYSA-N Synonym: 1-butyl-2,3-dimethylimidazolium tetrafluoroborate,1-n-butyl-2,3-dimethylimidazolium tetrafluoroborate,1-butyl-2,3-dimethylimidazol-1-ium tetrafluoroborate,3-butyl-1,2-dimethylimidazol-1-ium tetrafluoroborate,bdmim bf4,acmc-209jcq,dsstox_cid_27885,dsstox_rid_82638,dsstox_gsid_47909,ksc235m3b PubChem CID: 2734244 IUPAC Name: 1-butyl-2,3-dimethylimidazol-3-ium;tetrafluoroborate SMILES: F[B-](F)(F)F.CCCCN1C=C[N+](C)=C1C

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Specifications

PubChem CID	2734244
CAS	402846-78-0
Molecular Weight (g/mol)	240.05
MDL Number	MFCD03427618
SMILES	F[B-](F)(F)F.CCCCN1C=C[N+](C)=C1C
Synonym	1-butyl-2,3-dimethylimidazolium tetrafluoroborate,1-n-butyl-2,3-dimethylimidazolium tetrafluoroborate,1-butyl-2,3-dimethylimidazol-1-ium tetrafluoroborate,3-butyl-1,2-dimethylimidazol-1-ium tetrafluoroborate,bdmim bf4,acmc-209jcq,dsstox_cid_27885,dsstox_rid_82638,dsstox_gsid_47909,ksc235m3b
IUPAC Name	1-butyl-2,3-dimethylimidazol-3-ium;tetrafluoroborate
InChI Key	VCAIYEJBOWHUGP-UHFFFAOYSA-N
Molecular Formula	C9H17BF4N2

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1,2-Dimethylimidazole, 98%

CAS: 1739-84-0 Molecular Formula: C5H8N2 Molecular Weight (g/mol): 96.13 MDL Number: MFCD00005294 InChI Key: GIWQSPITLQVMSG-UHFFFAOYSA-N Synonym: 1,2-dimethyl-1h-imidazole,1h-imidazole, 1,2-dimethyl,imidazole, 1,2-dimethyl,1h-imidazole, dimethyl,unii-q41bc3grjb,q41bc3grjb,lupragen r dmi,1,2-dimethylimdazole,1,2 dimethylimidazole,n,2-dimethylimidazole PubChem CID: 15617 IUPAC Name: 1,2-dimethylimidazole SMILES: CN1C=CN=C1C

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Specifications

PubChem CID	15617
CAS	1739-84-0
Molecular Weight (g/mol)	96.13
MDL Number	MFCD00005294
SMILES	CN1C=CN=C1C
Synonym	1,2-dimethyl-1h-imidazole,1h-imidazole, 1,2-dimethyl,imidazole, 1,2-dimethyl,1h-imidazole, dimethyl,unii-q41bc3grjb,q41bc3grjb,lupragen r dmi,1,2-dimethylimdazole,1,2 dimethylimidazole,n,2-dimethylimidazole
IUPAC Name	1,2-dimethylimidazole
InChI Key	GIWQSPITLQVMSG-UHFFFAOYSA-N
Molecular Formula	C5H8N2

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1-n-Butyl-3-methylimidazolium dicyanamide, 97%

CAS: 448245-52-1 Molecular Formula: C10H15N5 Molecular Weight (g/mol): 205.265 MDL Number: MFCD07784457 InChI Key: ICIVTHOGIQHZRY-UHFFFAOYSA-N Synonym: 1-butyl-3-methylimidazolium dicyanamide,1-butyl-3-methylimidazolium dicyamide,1-butyl-3-methylimidazolium; dicyanoazanide,bmim dca,dsstox_cid_27886,dsstox_rid_82639,dsstox_gsid_47910,c4mim; dicyanoazanide,1-butyl-3-methyl-1h-imidazol-3-ium cyanoimino methylidene azanide,1-butyl-3-methylimidazolium; cyanoimino methylidene azanide PubChem CID: 11171745 IUPAC Name: 1-butyl-3-methylimidazol-3-ium;cyanoiminomethylideneazanide SMILES: CCCCN1C=C[N+](=C1)C.C(=[N-])=NC#N

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Specifications

PubChem CID	11171745
CAS	448245-52-1
Molecular Weight (g/mol)	205.265
MDL Number	MFCD07784457
SMILES	CCCCN1C=C[N+](=C1)C.C(=[N-])=NC#N
Synonym	1-butyl-3-methylimidazolium dicyanamide,1-butyl-3-methylimidazolium dicyamide,1-butyl-3-methylimidazolium; dicyanoazanide,bmim dca,dsstox_cid_27886,dsstox_rid_82639,dsstox_gsid_47910,c4mim; dicyanoazanide,1-butyl-3-methyl-1h-imidazol-3-ium cyanoimino methylidene azanide,1-butyl-3-methylimidazolium; cyanoimino methylidene azanide
IUPAC Name	1-butyl-3-methylimidazol-3-ium;cyanoiminomethylideneazanide
InChI Key	ICIVTHOGIQHZRY-UHFFFAOYSA-N
Molecular Formula	C10H15N5

4-(2-Methyl-1H-imidazol-1-yl)benzonitrile, 97%, Thermo Scientific™

CAS: 122957-50-0 Molecular Formula: C11H9N3 Molecular Weight (g/mol): 183.21 MDL Number: MFCD08559033 InChI Key: FAMJRKMLLLJOGZ-UHFFFAOYSA-N PubChem CID: 15005384 IUPAC Name: 4-(2-methyl-1H-imidazol-1-yl)benzonitrile SMILES: CC1=NC=CN1C1=CC=C(C=C1)C#N

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Specifications

PubChem CID	15005384
CAS	122957-50-0
Molecular Weight (g/mol)	183.21
MDL Number	MFCD08559033
SMILES	CC1=NC=CN1C1=CC=C(C=C1)C#N
IUPAC Name	4-(2-methyl-1H-imidazol-1-yl)benzonitrile
InChI Key	FAMJRKMLLLJOGZ-UHFFFAOYSA-N
Molecular Formula	C11H9N3

Miconazole Impurity A, British Pharmacopoeia (BP) Reference Standard, MilliporeSigma™ Supelco™

This product is provided as delivered and specified by the issuing Pharmacopoeia. All information provided in support of this product, including SDS and any product information leaflets, has been developed and issued under the Authority of the issuing Pharmacopoeia.

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4-(1H-Imidazol-1-ylmethyl)benzonitrile, ≥97%, Thermo Scientific™

CAS: 112809-54-8 Molecular Formula: C11H9N3 Molecular Weight (g/mol): 183.214 MDL Number: MFCD08060525 InChI Key: LUSFCTSUDCCYLQ-UHFFFAOYSA-N Synonym: 4-1h-imidazol-1-ylmethyl benzonitrile,4-imidazol-1-ylmethyl benzonitrile,1-4-cyanobenzyl imidazole,4-1h-imidazol-1-yl methyl benzonitrile,1-4-cyanobenzyl-1h-imidazole,4-imidazol-1-ylmethyl-benzonitrile,4-1-imidazolylmethyl-benzonitrile,benzonitrile,4-1h-imidazol-1-ylmethyl,acmc-1cab3 PubChem CID: 1236449 IUPAC Name: 4-(imidazol-1-ylmethyl)benzonitrile SMILES: C1=CC(=CC=C1CN2C=CN=C2)C#N

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Specifications

PubChem CID	1236449
CAS	112809-54-8
Molecular Weight (g/mol)	183.214
MDL Number	MFCD08060525
SMILES	C1=CC(=CC=C1CN2C=CN=C2)C#N
Synonym	4-1h-imidazol-1-ylmethyl benzonitrile,4-imidazol-1-ylmethyl benzonitrile,1-4-cyanobenzyl imidazole,4-1h-imidazol-1-yl methyl benzonitrile,1-4-cyanobenzyl-1h-imidazole,4-imidazol-1-ylmethyl-benzonitrile,4-1-imidazolylmethyl-benzonitrile,benzonitrile,4-1h-imidazol-1-ylmethyl,acmc-1cab3
IUPAC Name	4-(imidazol-1-ylmethyl)benzonitrile
InChI Key	LUSFCTSUDCCYLQ-UHFFFAOYSA-N
Molecular Formula	C11H9N3

5-Bromo-2-methyl-4-nitro-1H-imidazole, 97%, Thermo Scientific™

CAS: 18874-52-7 Molecular Formula: C4H4BrN3O2 Molecular Weight (g/mol): 205.999 MDL Number: MFCD00156130 InChI Key: YOJYWZSEUWUYAQ-UHFFFAOYSA-N Synonym: 4-bromo-2-methyl-5-nitro-1h-imidazole,5-bromo-2-methyl-4-nitroimidazole,4-bromo-2-methyl-5-nitro-3h-imidazole,4-bromo-2-methyl-5-nitroimidazole,1h-imidazole, 4-bromo-2-methyl-5-nitro,2-methyl-4-nitro-5-bromoimidazole,imidazole, 5-bromo-4-nitro-2-methyl,2-methyl-4-bromo-5-nitro-1h-imidazole,1h-imidazole,5-bromo-2-methyl-4-nitro,1h-imidazole, 5-bromo-2-methyl-4-nitro PubChem CID: 29322 IUPAC Name: 5-bromo-2-methyl-4-nitro-1H-imidazole SMILES: CC1=NC(=C(N1)Br)[N+](=O)[O-]

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Specifications

PubChem CID	29322
CAS	18874-52-7
Molecular Weight (g/mol)	205.999
MDL Number	MFCD00156130
SMILES	CC1=NC(=C(N1)Br)[N+](=O)[O-]
Synonym	4-bromo-2-methyl-5-nitro-1h-imidazole,5-bromo-2-methyl-4-nitroimidazole,4-bromo-2-methyl-5-nitro-3h-imidazole,4-bromo-2-methyl-5-nitroimidazole,1h-imidazole, 4-bromo-2-methyl-5-nitro,2-methyl-4-nitro-5-bromoimidazole,imidazole, 5-bromo-4-nitro-2-methyl,2-methyl-4-bromo-5-nitro-1h-imidazole,1h-imidazole,5-bromo-2-methyl-4-nitro,1h-imidazole, 5-bromo-2-methyl-4-nitro
IUPAC Name	5-bromo-2-methyl-4-nitro-1H-imidazole
InChI Key	YOJYWZSEUWUYAQ-UHFFFAOYSA-N
Molecular Formula	C4H4BrN3O2

5-Chloro-1-Methyl-4-Nitroimidazole, British Pharmacopoeia (BP) Reference Standard, MilliporeSigma™ Supelco™

BP Reference standard, intended for use in laboratory tests.

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3-(1H-Imidazol-1-ylmethyl)aniline, 97%, Thermo Scientific™

CAS: 120107-85-9 Molecular Formula: C10H11N3 Molecular Weight (g/mol): 173.219 InChI Key: HOZXQBSHRUITCX-UHFFFAOYSA-N Synonym: 3-1h-imidazol-1-ylmethyl aniline,3-1h-imidazol-1-yl methyl aniline,3-imidazol-1-ylmethyl aniline,benzenamine, 3-1h-imidazol-1-ylmethyl,3-1-imidazolylmethyl aniline,3-imidazol-1-ylmethyl-phenylamine,benzenamine,3-1h-imidazol-1-ylmethyl,3-imidazolylmethyl phenylamine,acmc-20e0av PubChem CID: 6481821 IUPAC Name: 3-(imidazol-1-ylmethyl)aniline SMILES: C1=CC(=CC(=C1)N)CN2C=CN=C2

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Specifications

PubChem CID	6481821
CAS	120107-85-9
Molecular Weight (g/mol)	173.219
SMILES	C1=CC(=CC(=C1)N)CN2C=CN=C2
Synonym	3-1h-imidazol-1-ylmethyl aniline,3-1h-imidazol-1-yl methyl aniline,3-imidazol-1-ylmethyl aniline,benzenamine, 3-1h-imidazol-1-ylmethyl,3-1-imidazolylmethyl aniline,3-imidazol-1-ylmethyl-phenylamine,benzenamine,3-1h-imidazol-1-ylmethyl,3-imidazolylmethyl phenylamine,acmc-20e0av
IUPAC Name	3-(imidazol-1-ylmethyl)aniline
InChI Key	HOZXQBSHRUITCX-UHFFFAOYSA-N
Molecular Formula	C10H11N3

N'-Hydroxy-3-(2-methyl-4-nitro-1H-imidazol-1-yl)propanimidamide, 97%, Thermo Scientific™

CAS: 301177-50-4 Molecular Formula: C7H11N5O3 Molecular Weight (g/mol): 213.20 MDL Number: MFCD01313054 InChI Key: DSFFWFHDJMMTGE-UHFFFAOYSA-N Synonym: n'-hydroxy-3-2-methyl-4-nitro-1h-imidazol-1-yl propanimidamide,ho∼lahkcld^isdfyuuenzejijafp,1-hydroxyimino-3-2-methyl-4-nitroimidazolyl propylamine,z-n'-hydroxy-3-2-methyl-4-nitroimidazol-1-yl propimidamide PubChem CID: 9555147 IUPAC Name: N'-hydroxy-3-(2-methyl-4-nitroimidazol-1-yl)propanimidamide SMILES: CC1=NC(=CN1CCC(N)=NO)[N+]([O-])=O

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Specifications

PubChem CID	9555147
CAS	301177-50-4
Molecular Weight (g/mol)	213.20
MDL Number	MFCD01313054
SMILES	CC1=NC(=CN1CCC(N)=NO)[N+]([O-])=O
Synonym	n'-hydroxy-3-2-methyl-4-nitro-1h-imidazol-1-yl propanimidamide,ho∼lahkcld^isdfyuuenzejijafp,1-hydroxyimino-3-2-methyl-4-nitroimidazolyl propylamine,z-n'-hydroxy-3-2-methyl-4-nitroimidazol-1-yl propimidamide
IUPAC Name	N'-hydroxy-3-(2-methyl-4-nitroimidazol-1-yl)propanimidamide
InChI Key	DSFFWFHDJMMTGE-UHFFFAOYSA-N
Molecular Formula	C7H11N5O3

Ethyl 1-methyl-1H-benzimidazole-5-carboxylate, 97%, Thermo Scientific™

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Methyl 4-(1H-imidazol-1-ylmethyl)benzoate, 97%, Thermo Scientific™

CAS: 160446-18-4 Molecular Formula: C12H12N2O2 Molecular Weight (g/mol): 216.24 MDL Number: MFCD00608318 InChI Key: HMWIIHIOSBESMH-UHFFFAOYSA-N Synonym: methyl 4-1h-imidazol-1-ylmethyl benzoate,methyl 4-imidazol-1-ylmethyl benzoate,methyl 4-1h-imidazol-1-yl methyl benzoate,methyl 4-imidazolylmethyl benzoate,4-imidazol-1-ylmethyl-benzoic acid methyl ester,4-1h-imidazol-1-ylmethyl benzoic acid methyl ester,benzoicacid, 4-1h-imidazol-1-ylmethyl-, methyl ester PubChem CID: 3164140 IUPAC Name: methyl 4-(imidazol-1-ylmethyl)benzoate SMILES: COC(=O)C1=CC=C(C=C1)CN2C=CN=C2

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Specifications

PubChem CID	3164140
CAS	160446-18-4
Molecular Weight (g/mol)	216.24
MDL Number	MFCD00608318
SMILES	COC(=O)C1=CC=C(C=C1)CN2C=CN=C2
Synonym	methyl 4-1h-imidazol-1-ylmethyl benzoate,methyl 4-imidazol-1-ylmethyl benzoate,methyl 4-1h-imidazol-1-yl methyl benzoate,methyl 4-imidazolylmethyl benzoate,4-imidazol-1-ylmethyl-benzoic acid methyl ester,4-1h-imidazol-1-ylmethyl benzoic acid methyl ester,benzoicacid, 4-1h-imidazol-1-ylmethyl-, methyl ester
IUPAC Name	methyl 4-(imidazol-1-ylmethyl)benzoate
InChI Key	HMWIIHIOSBESMH-UHFFFAOYSA-N
Molecular Formula	C12H12N2O2

[4-(1H-Imidazol-1-yl)phenyl]methanol, 97%, Thermo Scientific™

CAS: 86718-08-3 Molecular Formula: C10H10N2O Molecular Weight (g/mol): 174.203 MDL Number: MFCD02682059 InChI Key: SRQXVPAXMMIUFH-UHFFFAOYSA-N Synonym: 4-1h-imidazol-1-yl phenyl methanol,4-imidazol-1-yl-phenyl methanol,4-1-imidazolyl phenyl methanol,4-imidazol-1-ylphenyl methanol,4-1-imidazolyl benzyl alcohol,4-imidazol-1-yl phenyl methanol,benzenemethanol, 4-1h-imidazol-1-yl,acmc-209qb5,4-imidazolylphenyl methan-1-ol PubChem CID: 2776486 IUPAC Name: (4-imidazol-1-ylphenyl)methanol SMILES: C1=CC(=CC=C1CO)N2C=CN=C2

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Specifications

PubChem CID	2776486
CAS	86718-08-3
Molecular Weight (g/mol)	174.203
MDL Number	MFCD02682059
SMILES	C1=CC(=CC=C1CO)N2C=CN=C2
Synonym	4-1h-imidazol-1-yl phenyl methanol,4-imidazol-1-yl-phenyl methanol,4-1-imidazolyl phenyl methanol,4-imidazol-1-ylphenyl methanol,4-1-imidazolyl benzyl alcohol,4-imidazol-1-yl phenyl methanol,benzenemethanol, 4-1h-imidazol-1-yl,acmc-209qb5,4-imidazolylphenyl methan-1-ol
IUPAC Name	(4-imidazol-1-ylphenyl)methanol
InChI Key	SRQXVPAXMMIUFH-UHFFFAOYSA-N
Molecular Formula	C10H10N2O

1-phenyl-1H-imidazole-2-carbaldehyde, Thermo Scientific™

CAS: 6002-15-9 Molecular Formula: C10H8N2O Molecular Weight (g/mol): 172.187 InChI Key: VJDRBJPZIHUDNE-UHFFFAOYSA-N Synonym: 1-phenyl-1h-imidazole-2-carbaldehyde,1h-imidazole-2-carboxaldehyde, 1-phenyl,1h-imidazole-2-carbaldehyde, 1-phenyl,1-phenyl-2-formylimidazole,1-phenylimidazole-2-carboxaldehyde PubChem CID: 6424701 IUPAC Name: 1-phenylimidazole-2-carbaldehyde SMILES: C1=CC=C(C=C1)N2C=CN=C2C=O

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Specifications

PubChem CID	6424701
CAS	6002-15-9
Molecular Weight (g/mol)	172.187
SMILES	C1=CC=C(C=C1)N2C=CN=C2C=O
Synonym	1-phenyl-1h-imidazole-2-carbaldehyde,1h-imidazole-2-carboxaldehyde, 1-phenyl,1h-imidazole-2-carbaldehyde, 1-phenyl,1-phenyl-2-formylimidazole,1-phenylimidazole-2-carboxaldehyde
IUPAC Name	1-phenylimidazole-2-carbaldehyde
InChI Key	VJDRBJPZIHUDNE-UHFFFAOYSA-N
Molecular Formula	C10H8N2O

Imidazoles

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