AG000PTM

119879-90-2 | Benzenamine, 2-bromo-5-(phenylmethoxy)-

AG000PTM

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CAS Number	119879-90-2
Catalog Number	AG000PTM(AGN-PC-0NE7PU)
Chemical Name	Benzenamine, 2-bromo-5-(phenylmethoxy)-
IUPAC Name	2-bromo-5-phenylmethoxyaniline
InChI	InChI=1S/C13H12BrNO/c14-12-7-6-11(8-13(12)15)16-9-10-4-2-1-3-5-10/h1-8H,9,15H2
InChI Key	RTDSBDMPNWSMTH-UHFFFAOYSA-N
MDL Number	MFCD16038676
Molecular Formula	C13H12BrNO
Molecular Weight	278.1445
SMILES	NC1=CC(OCC2=CC=CC=C2)=CC=C1Br
Synonyms	5-(Benzyloxy)-2-bromoaniline, 119879-90-2, Benzenamine, 2-bromo-5-(phenylmethoxy)-, 5-Benzyloxy-2-bromoaniline, SCHEMBL810441, 2-Bromo-5-(benzyloxy)aniline, 5-benzyloxy-2-bromo-phenylamine, CTK8C4377, DTXSID10451423, (5-Benzyloxy-2-bromophenyl)amine, RTDSBDMPNWSMTH-UHFFFAOYSA-N, 3445AA, ANW-71694, MFCD16038676, ZINC66348306, AKOS015902009, FCH3047753, AS-47059, AJ-116488, AX8223237, DB-061670, TC-160439, FT-0747200, I14-13538, C13H12BrNO, 2-bromo-5-phenylmethoxy-aniline, CID11000366,

Complexity	206
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	277.01g/mol
Formal Charge	0
Heavy Atom Count	16
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	278.149g/mol
Monoisotopic Mass	277.01g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	35.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.4

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302
Packing Group
Precautionary statements	P280-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number