alpha-(3-Bromophenyl)benzylamine - CAS 55095-16-4

Catalog:	BB028909
Product Name:	alpha-(3-Bromophenyl)benzylamine
CAS:	55095-16-4
Synonyms:	(3-bromophenyl)-phenylmethanamine; (3-bromophenyl)-phenylmethanamine

Technical Data

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Computed Properties

IUPAC Name:	(3-bromophenyl)-phenylmethanamine
Description:	alpha-(3-Bromophenyl)benzylamine (CAS# 55095-16-4) is a useful research chemical.
Molecular Weight:	262.15
Molecular Formula:	C13H12BrN
Canonical SMILES:	C1=CC=C(C=C1)C(C2=CC(=CC=C2)Br)N
InChI:	InChI=1S/C13H12BrN/c14-12-8-4-7-11(9-12)13(15)10-5-2-1-3-6-10/h1-9,13H,15H2
InChI Key:	SPJBOTWJLJIHLV-UHFFFAOYSA-N
LogP:	4.19750

Publication Number	Title	Priority Date
WO-2021003295-A1	Modulators of hsd17b13 and methods of use thereof	20190702
US-2016145247-A1	Aminomethyl-Biaryl Derivatives Complement Factor D inhibitors and uses thereof	20130718
CN-101501040-A	Amino-imidazolones and their use as a medicament for treating cognitive impairment, Alzheimer disease, neurodegeneration and dementia	20060614
CN-101501041-A	Amino-imidazolones and their use as a medicament for treating cognitive impairment, alzheimer disease, neurodegeneration and dementia	20060614
EP-2035423-A1	Amino-imidazolones and their use as a medicament for treating cognitive impairment, alzheimer disease, neurodegeneration and dementia	20060614

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Complexity:	189
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	261.01531
Formal Charge:	0
Heavy Atom Count:	15
Hydrogen Bond Acceptor Count:	1
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	261.01531
Rotatable Bond Count:	2
Topological Polar Surface Area:	26
Undefined Atom Stereocenter Count:	1
Undefined Bond Stereocenter Count:	0
XLogP3:	3.2