AG003RKA

26663-77-4 | Methyl Benzimidazole-5-carboxylate

AG003RKA

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CAS Number	26663-77-4
Catalog Number	AG003RKA(AGN-PC-0KKZS1)
Chemical Name	Methyl Benzimidazole-5-carboxylate
IUPAC Name	methyl 3H-benzimidazole-5-carboxylate
InChI	InChI=1S/C9H8N2O2/c1-13-9(12)6-2-3-7-8(4-6)11-5-10-7/h2-5H,1H3,(H,10,11)
InChI Key	WJHHIVYNOVTVGY-UHFFFAOYSA-N
MDL Number	MFCD03407310
Molecular Formula	C9H8N2O2
Molecular Weight	176.1720
SMILES	N1=C[NH]C2=C1C=CC(=C2)C(=O)OC
Synonyms	26663-77-4, METHYL BENZIMIDAZOLE-5-CARBOXYLATE, Methyl 1H-benzimidazole-5-carboxylate, METHYL 1H-BENZO[D]IMIDAZOLE-5-CARBOXYLATE, 1H-Benzimidazole-5-carboxylic acid methyl ester, methyl 1H-1,3-benzodiazole-5-carboxylate, 1H-Benzimidazole-5-carboxylicacidmethylester, methyl 3H-benzimidazole-5-carboxylate, methyl 1H-benzo[d]imidazole-6-carboxylate, Benzimidazole-5-carboxylic Acid Methyl Ester, 1H-benzoimidazole-5-carboxylic acid methyl ester, 1H-Benzimidazole-5-carboxylic acid, methyl ester, MFCD03407310, PubChem16724, ACMC-209gsl, AC1MCW7D, Maybridge4_002683, AC1Q43NW, 5-Methoxycarbonylbenzimidazole, KSC201E3T, SCHEMBL1379298, 5-(Methoxycarbonyl)benzimidazole, CTK1A1239, Methyl 5-benzimidazolecarboxylate, DTXSID80381526, WJHHIVYNOVTVGY-UHFFFAOYSA-N, 6-methoxycarbonyl-1H-benzimidazole, HMS1528J21, ZINC161892, ACN-P001083, ACN-S004212, ACT07716, ANW-26035, BBL029958, CCG-52373, CL3438, SBB038171, STL259908, AKOS000268403, AKOS005264514, Methyl 1H-benzimidazole-6-carboxylate, AC-7533, AN-8881, CS-W022885, FS-2646, MCULE-5079522237, QC-9109, RP02986, RTR-012057, SDCCGMLS-0066161.P001, TRA0075652, IDI1_032561, methyl1H-benzo[d]imidazole-5-carboxylate, AJ-15822, AK-47426, BR-47426, CJ-02004, SC-93361, SY007514, 5-benzimidazolecarboxylic acid,methyl ester, methyl 3h-benzo[d]imidazole-5-carboxylate, AB0008695, AB1000971, DB-011185, TC-114780, TR-012057, 5-benzimidazolecarboxylic acid, methyl ester, A5257, FT-0628362, M2582, ST24031183, ST50160262, EN300-69243, M-2688, M67412, MFCD03407310 (95+%), 663B774, I10-0462, SR-01000641614-1, W-202134, BRD-K60861711-001-01-5, Z1250100670, null, C9H8N2O2, ZINC00161892, CID2779733, METHYL1H-BENZIMIDAZOLE-5-CARBOXYLATE, C2778, 1H-Benzimidazole-5-carboxylic acid, methyl ester (9CI),

Complexity	208
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	176.059g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	176.175g/mol
Monoisotopic Mass	176.059g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	55A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.7

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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