AG00EATO

56643-85-7 | 4-(1H-Imidazol-1-ylmethyl)aniline

AG00EATO

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CAS Number	56643-85-7
Catalog Number	AG00EATO(AGN-PC-0K2T58)
Chemical Name	4-(1H-Imidazol-1-ylmethyl)aniline
IUPAC Name	4-(imidazol-1-ylmethyl)aniline
InChI	InChI=1S/C10H11N3/c11-10-3-1-9(2-4-10)7-13-6-5-12-8-13/h1-6,8H,7,11H2
InChI Key	DGHAOTHIDTUSJY-UHFFFAOYSA-N
MDL Number	MFCD06660785
Molecular Formula	C10H11N3
Molecular Weight	173.2144
SMILES	C1=NC=C[N]1CC2=CC=C(N)C=C2
Synonyms	56643-85-7, 4-Imidazol-1-ylmethylphenylamine, 4-(1H-imidazol-1-ylmethyl)aniline, 4-((1H-imidazol-1-yl)methyl)aniline, 4-(imidazol-1-ylmethyl)aniline, 4-[(1-Imidazolyl)methyl]aniline, 4-Imidazol-1-ylmethyl-phenylamine, 1-(4-Aminobenzyl)imidazole, 4-(imidazolylmethyl)phenylamine, CHEMBL598389, 4-[(1H-Imidazol-1-yl)methyl]aniline, Benzenamine, 4-(1H-imidazol-1-ylmethyl)-, 1-(4-Aminobenzyl)-1H-imidazole, BAS 06504682, AC1LOLP2, SCHEMBL77025, AC1Q520P, CTK5A5496, 4-(imidazol-1-yl)methyl-aniline, DTXSID40361425, DGHAOTHIDTUSJY-UHFFFAOYSA-N, HMS1697K19, 4-(imidazol-1-yl-methyl)-aniline, ALBB-024125, KS-000009YE, ZINC1077916, ANW-51083, BDBM50307212, CA-931, MFCD06660785, SBB003818, AKOS000122812, 4-(1H-imidazol-1-ylmethyl)benzenamine, GS-4313, MCULE-7714221727, RP02818, TRA0000369, 4-[(1H-Imidazole-1-yl)methyl]aniline, 4-(1H-imidazol-1-ylmethyl)-benzenamine, 4-[(1H-imidazol-l-yl)methyl]benzenamine, AJ-24875, AK-21740, AN-40105, BR-21740, ST056815, SY028813, ZB015841, 4-[(1H-imidazol-1-yl)methyl]benzenamine, Benzenamine,4-(1H-imidazol-1-ylmethyl)-, AB0025548, DB-001588, ST2418411, TR-019860, 4CH-015660, AM20050509, BB 0253997, FT-0640403, W7030, EN300-12445, MFCD06660785 (95%), S-2973, 4-(1H-imidazol-1-ylmethyl)aniline, AldrichCPR, 643I857, J-513137, Z90122363, F2124-0449, I14-107506, D0HL9S, C10H11N3, CID1265319,

Complexity	152
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	173.095g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	173.219g/mol
Monoisotopic Mass	173.095g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	43.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.9

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H332-H335
Packing Group
Precautionary statements	P280-P305+P351+P338-P310
Signal Words	warning
UN Code

Certificate of Analysis

Lot Number