AG003NR1

55095-17-5 | (4-Bromophenyl)(phenyl)methanamine

AG003NR1

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CAS Number	55095-17-5
Catalog Number	AG003NR1(AGN-PC-0JQ8SI)
Chemical Name	(4-Bromophenyl)(phenyl)methanamine
IUPAC Name	(4-bromophenyl)-phenylmethanamine
InChI	InChI=1S/C13H12BrN/c14-12-8-6-11(7-9-12)13(15)10-4-2-1-3-5-10/h1-9,13H,15H2
InChI Key	CUGXLVXNFZFUFF-UHFFFAOYSA-N
MDL Number	MFCD06616841
Molecular Formula	C13H12BrN
Molecular Weight	262.1451
NSC Number	505710
SMILES	NC(C1=CC=C(Br)C=C1)C2=CC=CC=C2
Synonyms	(4-bromophenyl)(phenyl)methanamine, 55095-17-5, alpha-(4-Bromophenyl)benzylamine, CUGXLVXNFZFUFF-UHFFFAOYSA-N, NSC505710, AC1L6VFF, SCHEMBL2996334, (4-bromophenyl)-phenylmethanamine, KS-000009II, ZERO/005450, (4-bromophenyl)(phenyl) methanamine, MFCD06616841, SBB013431, STK686933, AKOS000138110, AKOS016048854, 1-(4-bromophenyl)-1-phenylmethanamine, MCULE-7864702532, NSC-505710, TRA0049369, CS-11397, ST084531, SY019319, AX8268512, TC-308060, Benzenemethanamine, 4-bromo-.alpha.-phenyl-, ST24034633, Y1235, EN300-58613, (R)-(4-BROMOPHENYL)(PHENYL)METHANAMINE, (S)-(4-BROMOPHENYL)(PHENYL)METHANAMINE, K-9869, MFCD06616841 (97+%), 220441-81-6, 220441-82-7, C13H12BrN, (4-bromophenyl)phenylmethylamine, CID350040, ACN-029042, 1736-74-9,

Complexity	181
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	261.015g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	262.15g/mol
Monoisotopic Mass	261.015g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	26A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	3.2

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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