AG000RRB

1261448-82-1 | (4-Bromo-3-methoxyphenyl)methanamine

AG000RRB

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CAS Number	1261448-82-1
Catalog Number	AG000RRB(AGN-PC-0WAN9L)
Chemical Name	(4-Bromo-3-methoxyphenyl)methanamine
IUPAC Name	(4-bromo-3-methoxyphenyl)methanamine
InChI	InChI=1S/C8H10BrNO/c1-11-8-4-6(5-10)2-3-7(8)9/h2-4H,5,10H2,1H3
InChI Key	RILRYVOMGCXQPY-UHFFFAOYSA-N
MDL Number	MFCD18391890
Molecular Formula	C8H10BrNO
Molecular Weight	216.0751
SMILES	NCC1=CC=C(Br)C(OC)=C1
Synonyms	(4-Bromo-3-methoxyphenyl)methanamine, 1261448-82-1, 4-Bromo-3-methoxybenzylamine, SCHEMBL18641945, MFCD18391890, ZINC82969746, AKOS022178261, DS-8075, Benzenemethanamine, 4-bromo-3-methoxy-, AK145200, AJ-125717, (2-((benzyloxy)methyl)phenyl)methanamine,

Complexity	121
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	214.995g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	216.078g/mol
Monoisotopic Mass	214.995g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	35.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.4

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H332-H335
Packing Group
Precautionary statements	P280-P305+P351+P338-P310
UN Code

Certificate of Analysis

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