Imidazoles

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

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241 – 255 of 2,987 results

241

1-Methyl-3-n-octylimidazolium Hexafluorophosphate 98.0+%, TCI America™

CAS: 304680-36-2 Molecular Formula: C12H23F6N2P Molecular Weight (g/mol): 340.29 MDL Number: MFCD03427617 InChI Key: GRCIJNHHTXBJAK-UHFFFAOYSA-N Synonym: 1-methyl-3-n-octylimidazolium hexafluorophosphate,3-methyl-1-octylimidazolium hexafluorophosphate,1-methyl-3-octylimidazolium hexafluorophosphate,1-octyl-3-methylimidazolium hexafluorophosphate,1-methyl-3-n-octylimidazoliumhexafluorophosphate,acmc-20aj2z,dsstox_cid_27928,dsstox_rid_82681,dsstox_gsid_47952,ksc222c5l PubChem CID: 2734243 IUPAC Name: 3-methyl-1-octyl-1H-imidazol-3-ium; hexafluoro-λ⁵-phosphanuide SMILES: F[P-](F)(F)(F)(F)F.CCCCCCCCN1C=C[N+](C)=C1

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Specifications

PubChem CID	2734243
CAS	304680-36-2
Molecular Weight (g/mol)	340.29
MDL Number	MFCD03427617
SMILES	F[P-](F)(F)(F)(F)F.CCCCCCCCN1C=C[N+](C)=C1
Synonym	1-methyl-3-n-octylimidazolium hexafluorophosphate,3-methyl-1-octylimidazolium hexafluorophosphate,1-methyl-3-octylimidazolium hexafluorophosphate,1-octyl-3-methylimidazolium hexafluorophosphate,1-methyl-3-n-octylimidazoliumhexafluorophosphate,acmc-20aj2z,dsstox_cid_27928,dsstox_rid_82681,dsstox_gsid_47952,ksc222c5l
IUPAC Name	3-methyl-1-octyl-1H-imidazol-3-ium; hexafluoro-λ⁵-phosphanuide
InChI Key	GRCIJNHHTXBJAK-UHFFFAOYSA-N
Molecular Formula	C12H23F6N2P

242

1-Bromo-3-phenylimidazo[1,5-a]pyridine 97.0+%, TCI America™

CAS: 104202-15-5 Molecular Formula: C13H9BrN2 Molecular Weight (g/mol): 273.13 MDL Number: MFCD04587511 InChI Key: ULKZZBGVTIZXSA-UHFFFAOYSA-N PubChem CID: 957540 IUPAC Name: 1-bromo-3-phenylimidazo[1,5-a]pyridine SMILES: BrC1=C2C=CC=CN2C(=N1)C1=CC=CC=C1

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Specifications

PubChem CID	957540
CAS	104202-15-5
Molecular Weight (g/mol)	273.13
MDL Number	MFCD04587511
SMILES	BrC1=C2C=CC=CN2C(=N1)C1=CC=CC=C1
IUPAC Name	1-bromo-3-phenylimidazo[1,5-a]pyridine
InChI Key	ULKZZBGVTIZXSA-UHFFFAOYSA-N
Molecular Formula	C13H9BrN2

243

1-Butyl-3-methylimidazolium Trifluoromethanesulfonate 98.0+%, TCI America™

CAS: 174899-66-2 Molecular Formula: C9H15F3N2O3S Molecular Weight (g/mol): 288.285 MDL Number: MFCD03427620 InChI Key: FRZPYEHDSAQGAS-UHFFFAOYSA-M Synonym: 1-butyl-3-methylimidazolium trifluoromethanesulfonate,1-butyl-3-methylimidazolium trifluoromethansulfonate,1-butyl-3-methylimidazolium triflate,c4mim triflate,bmim otf,acmc-1bwln,basionics™ vs 12,dsstox_cid_29088,dsstox_rid_83307,dsstox_gsid_49232 PubChem CID: 2734246 IUPAC Name: 1-butyl-3-methylimidazol-3-ium;trifluoromethanesulfonate SMILES: CCCCN1C=C[N+](=C1)C.C(F)(F)(F)S(=O)(=O)[O-]

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Specifications

PubChem CID	2734246
CAS	174899-66-2
Molecular Weight (g/mol)	288.285
MDL Number	MFCD03427620
SMILES	CCCCN1C=C[N+](=C1)C.C(F)(F)(F)S(=O)(=O)[O-]
Synonym	1-butyl-3-methylimidazolium trifluoromethanesulfonate,1-butyl-3-methylimidazolium trifluoromethansulfonate,1-butyl-3-methylimidazolium triflate,c4mim triflate,bmim otf,acmc-1bwln,basionics™ vs 12,dsstox_cid_29088,dsstox_rid_83307,dsstox_gsid_49232
IUPAC Name	1-butyl-3-methylimidazol-3-ium;trifluoromethanesulfonate
InChI Key	FRZPYEHDSAQGAS-UHFFFAOYSA-M
Molecular Formula	C9H15F3N2O3S

244

1-Butyl-2,3-dimethylimidazolium Trifluoromethanesulfonate 98.0+%, TCI America™

CAS: 765910-73-4 Molecular Formula: C10H17F3N2O3S Molecular Weight (g/mol): 302.312 MDL Number: MFCD03427624 InChI Key: KSOGGGZFEJTGPZ-UHFFFAOYSA-M Synonym: 1-butyl-2,3-dimethylimidazolium trifluoromethanesulfonate,1-butyl-2,3-dimethylimidazolium triflate,dsstox_cid_29315,dsstox_rid_83431,dsstox_gsid_49356,ksc496s6h,1-butyl-2,3-dimethylimidazol-1-ium triflate,3-butyl-1,2-dimethylimidazol-1-ium triflate,1-butyl-2,3-dimethylimidazolium trifluoromethansulfonate,1-butyl-2,3-dimethylimidazol-3-ium; trifluoromethanesulfonate PubChem CID: 2734250 IUPAC Name: 1-butyl-2,3-dimethylimidazol-3-ium;trifluoromethanesulfonate SMILES: CCCCN1C=C[N+](=C1C)C.C(F)(F)(F)S(=O)(=O)[O-]

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Specifications

PubChem CID	2734250
CAS	765910-73-4
Molecular Weight (g/mol)	302.312
MDL Number	MFCD03427624
SMILES	CCCCN1C=C[N+](=C1C)C.C(F)(F)(F)S(=O)(=O)[O-]
Synonym	1-butyl-2,3-dimethylimidazolium trifluoromethanesulfonate,1-butyl-2,3-dimethylimidazolium triflate,dsstox_cid_29315,dsstox_rid_83431,dsstox_gsid_49356,ksc496s6h,1-butyl-2,3-dimethylimidazol-1-ium triflate,3-butyl-1,2-dimethylimidazol-1-ium triflate,1-butyl-2,3-dimethylimidazolium trifluoromethansulfonate,1-butyl-2,3-dimethylimidazol-3-ium; trifluoromethanesulfonate
IUPAC Name	1-butyl-2,3-dimethylimidazol-3-ium;trifluoromethanesulfonate
InChI Key	KSOGGGZFEJTGPZ-UHFFFAOYSA-M
Molecular Formula	C10H17F3N2O3S

245

1,3-Dimesitylimidazolium Chloride 98.0+%, TCI America™

CAS: 141556-45-8 Molecular Formula: C21H25ClN2 Molecular Weight (g/mol): 340.90 MDL Number: MFCD02684541 InChI Key: OTOSIXGMLYKKOW-UHFFFAOYSA-M Synonym: 1,3-bis 2,4,6-trimethylphenyl imidazolium chloride,1,3-dimesityl-1h-imidazol-3-ium chloride,1,3-dimesitylimidazolium chloride,1,3-bis mesityl imidazolium chloride,imes.hcl,1,3-bis 2,4,6-trimethylphenyl imidazoliumchloride,1,3-2,4,6-trimethylphenyl imidazolium chloride,1,3-bis-2,4,6-trimethylphenyl-1h-imidazolium chloride,1,3-bis-2,4,6-trimethyl-phenyl-3h-imidazol-1-ium chloride,1,3-dihydro-1,3-dimesityl-2h-imidazol-2-ylidene monohydrochloride PubChem CID: 2734211 IUPAC Name: 1,3-bis(2,4,6-trimethylphenyl)-3H-1λ⁵-imidazol-1-ylium chloride SMILES: [Cl-].CC1=CC(C)=C(N2C=C[N+](=C2)C2=C(C)C=C(C)C=C2C)C(C)=C1

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Specifications

PubChem CID	2734211
CAS	141556-45-8
Molecular Weight (g/mol)	340.90
MDL Number	MFCD02684541
SMILES	[Cl-].CC1=CC(C)=C(N2C=C[N+](=C2)C2=C(C)C=C(C)C=C2C)C(C)=C1
Synonym	1,3-bis 2,4,6-trimethylphenyl imidazolium chloride,1,3-dimesityl-1h-imidazol-3-ium chloride,1,3-dimesitylimidazolium chloride,1,3-bis mesityl imidazolium chloride,imes.hcl,1,3-bis 2,4,6-trimethylphenyl imidazoliumchloride,1,3-2,4,6-trimethylphenyl imidazolium chloride,1,3-bis-2,4,6-trimethylphenyl-1h-imidazolium chloride,1,3-bis-2,4,6-trimethyl-phenyl-3h-imidazol-1-ium chloride,1,3-dihydro-1,3-dimesityl-2h-imidazol-2-ylidene monohydrochloride
IUPAC Name	1,3-bis(2,4,6-trimethylphenyl)-3H-1λ⁵-imidazol-1-ylium chloride
InChI Key	OTOSIXGMLYKKOW-UHFFFAOYSA-M
Molecular Formula	C21H25ClN2

246

4-Imidazolecarboxylic Acid 98.0+%, TCI America™

CAS: 1072-84-0 Molecular Formula: C4H4N2O2 Molecular Weight (g/mol): 112.09 MDL Number: MFCD00082203 InChI Key: NKWCGTOZTHZDHB-UHFFFAOYSA-N Synonym: 1h-imidazole-4-carboxylic acid,4-imidazolecarboxylic acid,imidazole-4-carboxylic acid,3h-imidazole-4-carboxylic acid,4-carboxyimidazole,unii-ae82z8u4gj,imidazole-5-carboxylic acid,4-imidazole carboxylic acid,ae82z8u4gj,4 5-imidazolecarboxylic acid PubChem CID: 14080 IUPAC Name: 1H-imidazole-5-carboxylic acid SMILES: OC(=O)C1=CN=CN1

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Specifications

PubChem CID	14080
CAS	1072-84-0
Molecular Weight (g/mol)	112.09
MDL Number	MFCD00082203
SMILES	OC(=O)C1=CN=CN1
Synonym	1h-imidazole-4-carboxylic acid,4-imidazolecarboxylic acid,imidazole-4-carboxylic acid,3h-imidazole-4-carboxylic acid,4-carboxyimidazole,unii-ae82z8u4gj,imidazole-5-carboxylic acid,4-imidazole carboxylic acid,ae82z8u4gj,4 5-imidazolecarboxylic acid
IUPAC Name	1H-imidazole-5-carboxylic acid
InChI Key	NKWCGTOZTHZDHB-UHFFFAOYSA-N
Molecular Formula	C4H4N2O2

247

5-Aminoimidazole-4-carboxamide 1-beta-D-Ribofuranoside 98.0+%, TCI America™

CAS: 2627-69-2 Molecular Formula: C9H14N4O5 Molecular Weight (g/mol): 258.23 MDL Number: MFCD00869751 InChI Key: RTRQQBHATOEIAF-UUOKFMHZSA-N Synonym: acadesine,aica-riboside,aicar,arasine,aica riboside,aic-riboside,acadesina,acadesinum,5-amino-1-beta-d-ribofuranosyl-1h-imidazole-4-carboxamide,protara PubChem CID: 17513 ChEBI: CHEBI:28498 IUPAC Name: 5-amino-1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-1H-imidazole-4-carboxamide SMILES: NC(=O)C1=C(N)N(C=N1)[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O

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Specifications

PubChem CID	17513
CAS	2627-69-2
Molecular Weight (g/mol)	258.23
ChEBI	CHEBI:28498
MDL Number	MFCD00869751
SMILES	NC(=O)C1=C(N)N(C=N1)[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O
Synonym	acadesine,aica-riboside,aicar,arasine,aica riboside,aic-riboside,acadesina,acadesinum,5-amino-1-beta-d-ribofuranosyl-1h-imidazole-4-carboxamide,protara
IUPAC Name	5-amino-1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-1H-imidazole-4-carboxamide
InChI Key	RTRQQBHATOEIAF-UUOKFMHZSA-N
Molecular Formula	C9H14N4O5

248

2-Phenylimidazole 98.0+%, TCI America™

CAS: 670-96-2 Molecular Formula: C9H8N2 Molecular Weight (g/mol): 144.18 MDL Number: MFCD00005186 InChI Key: ZCUJYXPAKHMBAZ-UHFFFAOYSA-N Synonym: 2-phenylimidazole,1h-imidazole, 2-phenyl,imidazole, 2-phenyl,2-phenyl imidazole,2-phenyl-1h-imidazol,unii-7r2590hm4l,chembl14189,phenyl imidazole,2-phenyl-imidazole,piy PubChem CID: 69591 IUPAC Name: 2-phenyl-1H-imidazole SMILES: N1C=CN=C1C1=CC=CC=C1

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Specifications

PubChem CID	69591
CAS	670-96-2
Molecular Weight (g/mol)	144.18
MDL Number	MFCD00005186
SMILES	N1C=CN=C1C1=CC=CC=C1
Synonym	2-phenylimidazole,1h-imidazole, 2-phenyl,imidazole, 2-phenyl,2-phenyl imidazole,2-phenyl-1h-imidazol,unii-7r2590hm4l,chembl14189,phenyl imidazole,2-phenyl-imidazole,piy
IUPAC Name	2-phenyl-1H-imidazole
InChI Key	ZCUJYXPAKHMBAZ-UHFFFAOYSA-N
Molecular Formula	C9H8N2

249

3,3'-Methylenebis(1-tert-butyl-3-imidazolium Bromide) 98.0+%, TCI America™

CAS: 247902-48-3 Molecular Formula: C15H26Br2N4 Molecular Weight (g/mol): 422.209 InChI Key: WKZMWHMEXVUXBS-UHFFFAOYSA-L PubChem CID: 11112632 IUPAC Name: 1-tert-butyl-3-[(3-tert-butylimidazol-1-ium-1-yl)methyl]imidazol-3-ium;dibromide SMILES: CC(C)(C)N1C=C[N+](=C1)C[N+]2=CN(C=C2)C(C)(C)C.[Br-].[Br-]

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Specifications

PubChem CID	11112632
CAS	247902-48-3
Molecular Weight (g/mol)	422.209
SMILES	CC(C)(C)N1C=C[N+](=C1)C[N+]2=CN(C=C2)C(C)(C)C.[Br-].[Br-]
IUPAC Name	1-tert-butyl-3-[(3-tert-butylimidazol-1-ium-1-yl)methyl]imidazol-3-ium;dibromide
InChI Key	WKZMWHMEXVUXBS-UHFFFAOYSA-L
Molecular Formula	C15H26Br2N4

250

Dimethyl 1H-Imidazole-4,5-dicarboxylate 98.0+%, TCI America™

CAS: 3304-70-9 Molecular Formula: C7H8N2O4 Molecular Weight (g/mol): 184.151 MDL Number: MFCD00051338 InChI Key: CUIWFAXEALIQJS-UHFFFAOYSA-N Synonym: dimethyl 4,5-imidazoledicarboxylate,1h-imidazole-4,5-dicarboxylic acid dimethyl ester,dimethyl imidazole-4,5-dicarboxylate,1h-imidazole-4,5-dicarboxylic acid, dimethyl ester,4,5-dimethyl 1h-imidazole-4,5-dicarboxylate,imidazole-4,5-dicarboxylic acid, dimethyl ester,dimethyl 4,5-imidazole-dicarboxylate,1h-imidazole-4,5-dicarboxylic acid, 4,5-dimethyl ester,imidazole-4, dimethyl ester,1h-imidazole-4, dimethyl ester PubChem CID: 76810 IUPAC Name: dimethyl 1H-imidazole-4,5-dicarboxylate SMILES: COC(=O)C1=C(N=CN1)C(=O)OC

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Specifications

PubChem CID	76810
CAS	3304-70-9
Molecular Weight (g/mol)	184.151
MDL Number	MFCD00051338
SMILES	COC(=O)C1=C(N=CN1)C(=O)OC
Synonym	dimethyl 4,5-imidazoledicarboxylate,1h-imidazole-4,5-dicarboxylic acid dimethyl ester,dimethyl imidazole-4,5-dicarboxylate,1h-imidazole-4,5-dicarboxylic acid, dimethyl ester,4,5-dimethyl 1h-imidazole-4,5-dicarboxylate,imidazole-4,5-dicarboxylic acid, dimethyl ester,dimethyl 4,5-imidazole-dicarboxylate,1h-imidazole-4,5-dicarboxylic acid, 4,5-dimethyl ester,imidazole-4, dimethyl ester,1h-imidazole-4, dimethyl ester
IUPAC Name	dimethyl 1H-imidazole-4,5-dicarboxylate
InChI Key	CUIWFAXEALIQJS-UHFFFAOYSA-N
Molecular Formula	C7H8N2O4

251

1-Butyl-3-methylimidazolium Thiocyanate 97.0+%, TCI America™

CAS: 344790-87-0 Molecular Formula: C9H15N3S Molecular Weight (g/mol): 197.3 MDL Number: MFCD06798181 InChI Key: SIXHYMZEOJSYQH-UHFFFAOYSA-M PubChem CID: 11424151 IUPAC Name: 1-butyl-3-methylimidazol-3-ium;thiocyanate SMILES: CCCCN1C=C[N+](=C1)C.C(#N)[S-]

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Specifications

PubChem CID	11424151
CAS	344790-87-0
Molecular Weight (g/mol)	197.3
MDL Number	MFCD06798181
SMILES	CCCCN1C=C[N+](=C1)C.C(#N)[S-]
IUPAC Name	1-butyl-3-methylimidazol-3-ium;thiocyanate
InChI Key	SIXHYMZEOJSYQH-UHFFFAOYSA-M
Molecular Formula	C9H15N3S

252

N-tert-Butoxycarbonylimidazole 98.0+%, TCI America™

CAS: 49761-82-2 Molecular Formula: C8H12N2O2 Molecular Weight (g/mol): 168.196 MDL Number: MFCD00014497 InChI Key: MTBKGWHHOBJMHJ-UHFFFAOYSA-N Synonym: n-boc-imidazole,tert-butyl 1h-imidazole-1-carboxylate,n-tert-butoxycarbonylimidazole,1-tert-butoxycarbonyl imidazole,1h-imidazole-1-carboxylic acid, 1,1-dimethylethyl ester,imidazole-1-carboxylic acid tert-butyl ester,tert-butyl imidazolecarboxylate,1-boc-imidazole,acmc-209ki1,ksc237k5p PubChem CID: 521262 IUPAC Name: tert-butyl imidazole-1-carboxylate SMILES: CC(C)(C)OC(=O)N1C=CN=C1

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Specifications

PubChem CID	521262
CAS	49761-82-2
Molecular Weight (g/mol)	168.196
MDL Number	MFCD00014497
SMILES	CC(C)(C)OC(=O)N1C=CN=C1
Synonym	n-boc-imidazole,tert-butyl 1h-imidazole-1-carboxylate,n-tert-butoxycarbonylimidazole,1-tert-butoxycarbonyl imidazole,1h-imidazole-1-carboxylic acid, 1,1-dimethylethyl ester,imidazole-1-carboxylic acid tert-butyl ester,tert-butyl imidazolecarboxylate,1-boc-imidazole,acmc-209ki1,ksc237k5p
IUPAC Name	tert-butyl imidazole-1-carboxylate
InChI Key	MTBKGWHHOBJMHJ-UHFFFAOYSA-N
Molecular Formula	C8H12N2O2

253

Etomidate 98.0+%, TCI America™

CAS: 33125-97-2 Molecular Formula: C14H16N2O2 Molecular Weight (g/mol): 244.294 MDL Number: MFCD00869295 InChI Key: NPUKDXXFDDZOKR-NSHDSACASA-N Synonym: etomidate,+-etomidate,d-etomidate,etomidato,etomidatum,amidate,hypnomidate,r-ethyl 1-1-phenylethyl-1h-imidazole-5-carboxylate,etomidatum inn-latin PubChem CID: 6338045 IUPAC Name: ethyl 3-[(1S)-1-phenylethyl]imidazole-4-carboxylate SMILES: CCOC(=O)C1=CN=CN1C(C)C2=CC=CC=C2

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Specifications

PubChem CID	6338045
CAS	33125-97-2
Molecular Weight (g/mol)	244.294
MDL Number	MFCD00869295
SMILES	CCOC(=O)C1=CN=CN1C(C)C2=CC=CC=C2
Synonym	etomidate,+-etomidate,d-etomidate,etomidato,etomidatum,amidate,hypnomidate,r-ethyl 1-1-phenylethyl-1h-imidazole-5-carboxylate,etomidatum inn-latin
IUPAC Name	ethyl 3-[(1S)-1-phenylethyl]imidazole-4-carboxylate
InChI Key	NPUKDXXFDDZOKR-NSHDSACASA-N
Molecular Formula	C14H16N2O2

254

3-Phenylimidazo[1,5-a]pyridine 98.0+%, TCI America™

CAS: 35854-46-7 Molecular Formula: C13H10N2 Molecular Weight (g/mol): 194.237 InChI Key: BLGGTXOVNVHSSV-UHFFFAOYSA-N PubChem CID: 606670 IUPAC Name: 3-phenylimidazo[1,5-a]pyridine SMILES: C1=CC=C(C=C1)C2=NC=C3N2C=CC=C3

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Specifications

PubChem CID	606670
CAS	35854-46-7
Molecular Weight (g/mol)	194.237
SMILES	C1=CC=C(C=C1)C2=NC=C3N2C=CC=C3
IUPAC Name	3-phenylimidazo[1,5-a]pyridine
InChI Key	BLGGTXOVNVHSSV-UHFFFAOYSA-N
Molecular Formula	C13H10N2

255

2-Bromo-4-nitroimidazole 98.0+%, TCI America™

CAS: 65902-59-2 Molecular Formula: C3H2BrN3O2 Molecular Weight (g/mol): 191.972 MDL Number: MFCD09038915 InChI Key: UWRJWMLKEHRGOH-UHFFFAOYSA-N Synonym: 2-bromo-4-nitroimidazole,2-bromo-4-nitro-1h-imidazole,2-bromo-4-nitro-3h-imidazole,2-bromo-5-nitroimidazole,1h-imidazole, 2-bromo-4-nitro,nitrobromoimidazole,pubchem20161,acmc-20aiz1,acmc-1b2vr PubChem CID: 47754 IUPAC Name: 2-bromo-5-nitro-1H-imidazole SMILES: C1=C(NC(=N1)Br)[N+](=O)[O-]

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Specifications

PubChem CID	47754
CAS	65902-59-2
Molecular Weight (g/mol)	191.972
MDL Number	MFCD09038915
SMILES	C1=C(NC(=N1)Br)[N+](=O)[O-]
Synonym	2-bromo-4-nitroimidazole,2-bromo-4-nitro-1h-imidazole,2-bromo-4-nitro-3h-imidazole,2-bromo-5-nitroimidazole,1h-imidazole, 2-bromo-4-nitro,nitrobromoimidazole,pubchem20161,acmc-20aiz1,acmc-1b2vr
IUPAC Name	2-bromo-5-nitro-1H-imidazole
InChI Key	UWRJWMLKEHRGOH-UHFFFAOYSA-N
Molecular Formula	C3H2BrN3O2

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