AG003D24

53087-13-1 | 3-Benzyloxybromobenzene

AG003D24

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CAS Number	53087-13-1
Catalog Number	AG003D24(AGN-PC-0KKL6W)
Chemical Name	3-Benzyloxybromobenzene
IUPAC Name	1-bromo-3-phenylmethoxybenzene
InChI	InChI=1S/C13H11BrO/c14-12-7-4-8-13(9-12)15-10-11-5-2-1-3-6-11/h1-9H,10H2
InChI Key	HVWZMGZBJCJDOX-UHFFFAOYSA-N
MDL Number	MFCD00155065
Molecular Formula	C13H11BrO
Molecular Weight	263.1298
SMILES	BrC1=CC=CC(OCC2=CC=CC=C2)=C1
Synonyms	1-(benzyloxy)-3-bromobenzene, 53087-13-1, 3-Benzyloxybromobenzene, Benzyl 3-Bromophenyl Ether, 1-Benzyloxy-3-bromobenzene, 1-bromo-3-benzyloxybenzene, 3-(benzyloxy)bromobenzene, 3-bromophenyl benzyl ether, BENZENE, 1-BROMO-3-(PHENYLMETHOXY)-, 1-benzyloxy-3-bromo-benzene, 3-Benzyloxybromobenzene, 96%, PubChem3065, 3-Benzyloxy-bromobenzene, 3-Bromophenylbenzyl ether, 3-Benzyloxy-1-bromobenzene, AC1MBU16, 1-benzyloxy-3-bromo benzene, 1-bromo-3-benzyloxy-benzene, SCHEMBL73864, 3-(benzyloxy)-1-bromobenzene, HDH-PHARMA 24756, 1-bromo-3-phenylmethoxybenzene, ACMC-209l45, 3-(phenylmethoxy)phenyl bromide, 3-Bromophenyl phenylmethyl ether, CTK3J7978, HVWZMGZBJCJDOX-UHFFFAOYSA-, KS-00000NHQ, DTXSID50373458, 1-bromo-3-(phenylmethoxy)benzene, 3-bromo-1-(phenylmethoxy)benzene, HVWZMGZBJCJDOX-UHFFFAOYSA-N, OTAVA-BB 1824552, ACT03962, ZINC2530751, ANW-31635, MFCD00155065, SBB067487, 1-BROMO-3-(BENZYLOXY)BENZENE, AKOS000202050, AM62513, AS02353, CS-W004106, MCULE-1695686353, PS-7351, RTR-018787, TRA0033609, VZ26376, AJ-38505, AK-61852, AN-40864, BC002396, SC-05097, SY046983, 1-BROMO-3-(PHENYLMETHOXY)-BENZENE, AB0042775, DB-022290, TR-018787, FT-0640128, ST24037550, ST51042133, Z0666, MFCD00155065 (98%), C-5127, I14-3685, InChI=1/C13H11BrO/c14-12-7-4-8-13(9-12)15-10-11-5-2-1-3-6-11/h1-9H,10H2, C13H11BrO, 1-bromo-4-(phenylmethoxy)benzene, ZINC02530751, CID2756638, 3-Benzyloxybromobenzene, 97% - 1G 1g, A7733, B2307,

Complexity	177
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	261.999g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	263.134g/mol
Monoisotopic Mass	261.999g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	9.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	4.5

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H413
Packing Group
Precautionary statements	P264-P270-P273-P301+P312-P330
UN Code	\N

Certificate of Analysis

Lot Number