AG0032HW

712-76-5 | 4-Phenylbenzylamine

AG0032HW

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CAS Number	712-76-5
Catalog Number	AG0032HW(AGN-PC-0JMGJH)
Chemical Name	4-Phenylbenzylamine
IUPAC Name	(4-phenylphenyl)methanamine
InChI	InChI=1S/C13H13N/c14-10-11-6-8-13(9-7-11)12-4-2-1-3-5-12/h1-9H,10,14H2
InChI Key	RMSPOVPGDBDYKH-UHFFFAOYSA-N
MDL Number	MFCD01310838
Molecular Formula	C13H13N
Molecular Weight	183.2490
NSC Number	402180
SMILES	C1(=CC=CC=C1)C1=CC=C(CN)C=C1
Synonyms	4-Phenylbenzylamine, 712-76-5, [1,1'-Biphenyl]-4-ylmethanamine, (4-phenylphenyl)methanamine, 4-(aminomethyl)biphenyl, 4-phenylbenzyl amine, [1,1'-Biphenyl]-4-methanamine, (4-phenylphenyl)methylamine, C-biphenyl-4-yl-methylamine, {[1,1'-biphenyl]-4-yl}methanamine, 4-phenyl benzylamine, 4-phenyl-benzylamine, NSC402180, 4-Biphenylmethylamine, 4 - Phenylbenzylamine, PubChem16830, 4-(phenyl)benzyl amine, ACMC-1BCZN, biphenyl-4-ylmethylamine, Biphenyl-4-ylmethanamine, biphenyl-4-yl-methylamine, (biphenyl-4-ylmethyl)amine, 4-Phenylbenzylamine, 97%, AC1Q53XI, benzenemethanamine, 4-phenyl-, SCHEMBL131842, 1-(biphenyl-4-yl)methanamine, AC1L81T1, CHEMBL216761, 1,1'-biphenyl-4-ylmethylamine, CTK2H8716, KS-00001OTX, DTXSID60322856, RMSPOVPGDBDYKH-UHFFFAOYSA-N, [1,1'-biphenyl]-4-ylmethylamine, 4PNA-0-0, STR08023, ZINC1594700, [1,1\'-Biphenyl]-4-ylmethanamine, ANW-74476, AR1994, MFCD01310838, SBB042703, STL280126, AKOS000131316, GL-0259, MCULE-5958094922, NSC-402180, TRA0002377, AJ-27786, AN-47385, DB-074413, TR-023473, FT-0676244, ST24050387, ST50817551, X5367, EN300-33149, C-5885, 712P765, I01-13492, C(N)c1ccc(cc1)c2ccccc2, C13H13N, CID344989, C-Biphenyl-4-yl-methylamine 1HCl salt,

Complexity	153
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	183.105g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	183.254g/mol
Monoisotopic Mass	183.105g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	26A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.1

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	3
Hazard statements	H315-H319-H335
Packing Group	Ⅲ
Precautionary statements	P261-P305+P351+P338
UN Code	UN 1993

Certificate of Analysis

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