AG00IK2C

98298-49-8 | Benzonitrile, 4-(1H-imidazol-2-yl)-

AG00IK2C

SDS

COA

Price

$0.00

Add to Cart

Buy Now

WARNING This product is not for human or veterinary use.

CAS Number	98298-49-8
Catalog Number	AG00IK2C(AGN-PC-0JWK1U)
Chemical Name	Benzonitrile, 4-(1H-imidazol-2-yl)-
IUPAC Name	4-(1H-imidazol-2-yl)benzonitrile
InChI	InChI=1S/C10H7N3/c11-7-8-1-3-9(4-2-8)10-12-5-6-13-10/h1-6H,(H,12,13)
InChI Key	ISJCKCQDMBPKML-UHFFFAOYSA-N
MDL Number	MFCD05863386
Molecular Formula	C10H7N3
Molecular Weight	169.1827
SMILES	N#CC1=CC=C(C=C1)C1=NC=CN1
Synonyms	4-(1H-imidazol-2-yl)benzonitrile, 98298-49-8, 4-(Imidazol-2-yl)benzonitrile, 2-(4-cyanophenyl)-1H-imidazole, Benzonitrile, 4-(1H-imidazol-2-yl)-, 4-(1H-IMIDAZOL-2-YL)-BENZONITRILE, AC1LGGRN, SCHEMBL378124, CTK5H9808, KS-00000EFR, DTXSID60356272, ISJCKCQDMBPKML-UHFFFAOYSA-N, 4-imidazol-2-ylbenzenecarbonitrile, ZINC337677, 5931AJ, MFCD05863386, SBB088292, AKOS006281906, Benzonitrile,4-(1H-imidazol-2-yl)-, AJ-19867, AS-47982, SY012466, ZB010876, AB0162353, DB-080511, TC-307562, FT-0692286, ST24042795, MFCD05863386 (95%), 4- -BENZONITRILE, 2-(4-Methylphenyl)imidazole, C10H7N3, CID821026, ZINC00337677, L-1573, 149104-90-5,

Complexity	210
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	169.064g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	169.187g/mol
Monoisotopic Mass	169.064g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	52.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.6

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number