AG006C0H

91874-85-0 | (2,3-Dimethylphenyl)(1H-imidazol-4-yl)methanone

AG006C0H

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CAS Number	91874-85-0
Catalog Number	AG006C0H(AGN-PC-0ON098)
Chemical Name	(2,3-Dimethylphenyl)(1H-imidazol-4-yl)methanone
IUPAC Name	(2,3-dimethylphenyl)-(1H-imidazol-5-yl)methanone
InChI	InChI=1S/C12H12N2O/c1-8-4-3-5-10(9(8)2)12(15)11-6-13-7-14-11/h3-7H,1-2H3,(H,13,14)
InChI Key	RXMJMOMMINVJMY-UHFFFAOYSA-N
MDL Number	MFCD21332884
Molecular Formula	C12H12N2O
Molecular Weight	200.2365
SMILES	O=C(C1=CC=CC(C)=C1C)C2=CNC=N2
Synonyms	(2,3-Dimethylphenyl)(1H-imidazol-4-yl)methanone, 91874-85-0, Methanone, (2,3-dimethylphenyl)-1H-imidazol-4-yl-, AK128046, J-500572, ACMC-20lv3t, Medetomidine Impurity 6, (2,3-Dimethylphenyl)(1H-imidazol-5-yl)methanone, SCHEMBL11049910, CTK3G3436, DTXSID10577819, MFCD21332884, ZINC34741226, 4-(2',3'-Dimethylbenzoyl)imidazole, AKOS016013473, CS-W007117, DS-5722, LS41168, RL05796, AJ-90020, AX8249837, AM20080951, FT-0747670, ST24033711, (2,3-dimethylphenyl)-(1H-imidazol-5-yl)methanone, Methanone, (2,3-dimethylphenyl)-1H-imidazol-5-yl-, CS-O-31850,

Complexity	242
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	200.095g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	200.241g/mol
Monoisotopic Mass	200.095g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	45.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.5

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

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