AG00EBPR

61613-22-7 | 2-Bromodiphenylamine

AG00EBPR

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CAS Number	61613-22-7
Catalog Number	AG00EBPR(AGN-PC-0LTDFW)
Chemical Name	2-Bromodiphenylamine
IUPAC Name	2-bromo-N-phenylaniline
InChI	InChI=1S/C12H10BrN/c13-11-8-4-5-9-12(11)14-10-6-2-1-3-7-10/h1-9,14H
InChI Key	WAAWAHYRHUWAFM-UHFFFAOYSA-N
MDL Number	MFCD01851817
Molecular Formula	C12H10BrN
Molecular Weight	248.1185
SMILES	Brc1ccccc1Nc1ccccc1
Synonyms	2-Bromodiphenylamine, 2-bromo-N-phenylaniline, 61613-22-7, Benzenamine, 2-bromo-N-phenyl-, WAAWAHYRHUWAFM-UHFFFAOYSA-N, N-(2-bromophenyl)aniline, AC1O50RF, 2-bromo-N-phenylbenzeneamine, SCHEMBL3270611, CTK2D6273, DTXSID70423762, ZINC5589819, MFCD01851817, CS-0059965, FT-0714155, 2-bromo-N-phenylbenzenamine, CID6425787,

Complexity	166
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	247g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	248.123g/mol
Monoisotopic Mass	247g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	12A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	4.2

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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