(S) - (4-Bromophenyl) (phenyl) methanamine

CAT: 0127-OR1051141-01Size: 100 mgDry Ice: NoHazardous: No

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CAT#:0127-OR1051141-01Size:100 mg

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CAS Number

220441-82-7

MDL Number

MFCD22423815

Purity

95%

Smiles

N[C@@H](C1=CC=CC=C1)C2=CC=C(C=C2)Br

Chemical Information

(S)-(4-Bromophenyl)(phenyl)methanamine

CAS Number	220441-82-7
PubChem CID	962587
IUPAC Name	(S)-(4-bromophenyl)-phenylmethanamine
Molecular Formula	C13H12BrN
Molecular Weight	262.14
XLogP	3.2
Topological Polar Surface Area	26
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	2
Heavy Atom Count	15
Formal Charge	0
Complexity	181

SMILES

C1=CC=C(C=C1)[C@@H](C2=CC=C(C=C2)Br)N

InChI

InChI=1S/C13H12BrN/c14-12-8-6-11(7-9-12)13(15)10-4-2-1-3-5-10/h1-9,13H,15H2/t13-/m0/s1

InChIKey

CUGXLVXNFZFUFF-ZDUSSCGKSA-N

Chemical Structure

2D Structure

CAS: 220441-82-7

CID: 962587

Formula: C13H12BrN

MW: 262.14

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	262.14
XLogP3	3.2
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	2
Exact Mass	261.01531
Monoisotopic Mass	261.01531
Topological Polar Surface Area	26 Å²
Heavy Atom Count	15
Formal Charge	0
Complexity	181
Isotope Atom Count	0
Defined Atom Stereocenter Count	1
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
OR1071552	(R) - (4-Bromophenyl) (phenyl) methanamine
OR1060915-01	(R) - (4-Bromophenyl) (phenyl) methanamine hydrochloride
OR1100280-01	(S) - (4-Bromophenyl) (cyclopropyl) methanamine (hydrochloride)
OR1056301-01	(S) - (4-Chlorophenyl) (phenyl) methanamine
PC101526-01	(S) -Phenyl (4- (trifluoromethyl) phenyl) methanamine hydrochloride
OR82022-01	(S) - (4-Chlorophenyl) (phenyl) methanamine hydrochloride
OR1065332-01	(S) -Cyclopropyl (phenyl) methanamine
OR1033971-01	(1- (4-Bromophenyl) cyclopropyl) methanamine
OR1002174-01	(4-Bromophenyl) (cyclobutyl) methanamine hydrochloride
PC1026235-01	Phenyl (4- (trifluoromethyl) phenyl) methanamine

Catalog	Name
HY-W569932-01	(R) - (4-Bromophenyl) (phenyl) methanamine
AL BW 0325-01	[4-[4- (aminomethyl) phenyl]phenyl]methanamine
KDB93639-01	Phenyl[4- (trifluoromethoxy) phenyl]methanamine
HFA71905	(4- (Methoxymethyl) phenyl) methanamine
RG-A263022-01	(4-Chlorophenyl) (Phenyl) Methanamine
sc-348352A	[4- (methanesulfonylmethyl) phenyl]methanamine
JDA21205-01	[4- (Phenylsulfanyl) phenyl]methanamine
HAA66283-01	[4- (Trimethylsilyl) phenyl]methanamine
AEA61742-01	[4- (Cyclohexyloxy) phenyl]methanamine
AL BW 0175-01	[4- (bromomethyl) phenyl]methanamine