AG003EXK

2208-59-5 | 2-(Pyridin-4-yl)-1H-benzo[d]imidazole

AG003EXK

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CAS Number	2208-59-5
Catalog Number	AG003EXK(AGN-PC-0JOK2O)
Chemical Name	2-(Pyridin-4-yl)-1H-benzo[d]imidazole
IUPAC Name	2-pyridin-4-yl-1H-benzimidazole
InChI	InChI=1S/C12H9N3/c1-2-4-11-10(3-1)14-12(15-11)9-5-7-13-8-6-9/h1-8H,(H,14,15)
InChI Key	UYWWLYCGNNCLKE-UHFFFAOYSA-N
MDL Number	MFCD00453948
Molecular Formula	C12H9N3
Molecular Weight	195.2200
NSC Number	62609
SMILES	C1(C2=CC=NC=C2)=NC3=CC=CC=C3N1
Synonyms	2208-59-5, 2-(4-Pyridyl)benzimidazole, 2-(pyridin-4-yl)-1H-benzo[d]imidazole, 2-pyridin-4-yl-1H-benzimidazole, 2-(pyridin-4-yl)-1h-benzimidazole, 2-(pyridin-4-yl)-1H-1,3-benzodiazole, MLS000709114, MLS000736695, 2-(4-pyridyl)-1H-benzimidazole, UYWWLYCGNNCLKE-UHFFFAOYSA-N, 2-Pyridin-4-yl-1H-benzoimidazole, MFCD00453948, SMR000282981, 2-Benzimidazole, NSC62609, AC1L6KOQ, AC1Q4YRE, ACMC-1CH3H, Cambridge id 5231114, NCIOpen2_000009, Oprea1_021863, Oprea1_792619, SCHEMBL695990, 2-(4-pyridinyl)-benzimidazole, CHEMBL379376, cid_247634, BDBM55759, CTK4E8512, DTXSID80289654, Benzimidazole, 2-(4-pyridinyl)-, HMS2691B22, ZINC151887, 2-(4-Pyridinyl)-1H-benzimidazole, ALBB-017633, KS-000016BZ, 1H-Benzimidazole,2-(4-pyridinyl)-, 7551AD, ANW-24710, NSC-62609, SBB045205, STK727086, 1H-Benzimidazole, 2-(4-pyridinyl)-, 2-(4-Pyridinyl)-1H-benzimidazole #, AKOS000275319, ACN-050137, MCULE-2120785380, 2-(4-pyridyl)-1H-1,3-benzimidazole, AJ-12706, BAS 00015610, ZB005131, ST4020009, TC-113455, 4CH-025010, BB 0219594, FT-0740218, P1658, ST24039751, L-4466, AE-848/30862035, SR-01000391502, SR-01000391502-1, I14-99733, F0191-4540, A0949/0044427, C12H9N3, AR-1C9847, CID247634, 1H-Benzimidazole, 2-(4-pyridinyl)- (9CI), 2H-Benzimidazole, 2-(4(1H)-pyridinylidene)- (9CI), 176964-61-7, 2520-21-0,

Complexity	213
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	195.08g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	195.225g/mol
Monoisotopic Mass	195.08g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	41.6A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.2

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H315-H319
Packing Group
Precautionary statements	P264-P280-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313
UN Code

Certificate of Analysis

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