(4-Bromo-3-chlorophenyl) methanamine

CAT: 0127-OR1066967-01Size: 100 mgDry Ice: NoHazardous: No

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CAT#:0127-OR1066967-01Size:100 mg

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24/48H Stock Items & 2 to 6 Weeks non Stock Items.

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CAS Number

1208076-65-6

MDL Number

MFCD12026285

Purity

95%

Smiles

NCC1=CC=C(Br)C(Cl)=C1

Chemical Information

(4-Bromo-3-chlorophenyl)methanamine

CAS Number	1208076-65-6
PubChem CID	50998128
IUPAC Name	(4-bromo-3-chlorophenyl)methanamine
Molecular Formula	C7H7BrClN
Molecular Weight	220.49
XLogP	2.1
Topological Polar Surface Area	26
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	1
Heavy Atom Count	10
Formal Charge	0
Complexity	110

SMILES

C1=CC(=C(C=C1CN)Cl)Br

InChI

InChI=1S/C7H7BrClN/c8-6-2-1-5(4-10)3-7(6)9/h1-3H,4,10H2

InChIKey

HQEHGBULSMIQAN-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 1208076-65-6

CID: 50998128

Formula: C7H7BrClN

MW: 220.49

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	220.49
XLogP3	2.1
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	1
Exact Mass	218.94504
Monoisotopic Mass	218.94504
Topological Polar Surface Area	26 Å²
Heavy Atom Count	10
Formal Charge	0
Complexity	110
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
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
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OR1059450-01	(2-Bromo-5-chlorophenyl) methanamine
OR1008165-01	(4-Chlorophenyl) Methanamine Hydrochloride

Catalog	Name
IYB07665	(4-Bromo-3-chlorophenyl) methanamine
AL BW 2448-01	(4-bromo-2-chlorophenyl) methanamine
BDB21244-01	(3-Chlorophenyl) (4-chlorophenyl) methanamine
YGD27370	(2-Bromo-4-chlorophenyl) methanamine hydrochloride
KJB18308-01	(4-Chlorophenyl) (3-methoxyphenyl) methanamine
BDB21245-01	(3-Chlorophenyl) (4-methylphenyl) methanamine
RQB74915-01	(3-Chlorophenyl) (4-methoxyphenyl) methanamine
RQB72928-01	(4-Chlorophenyl) (3-fluorophenyl) methanamine
IKC52285-01	[1- (4-Bromo-2-chlorophenyl) cyclopropyl]methanamine
UQB39584-01	(4-Chlorophenyl) (3-methylphenyl) methanamine