(4-chloro-3-fluorophenyl) methanamine

CAT: 1731-AL BW 1597-01Size: 1 mgDry Ice: NoHazardous: No

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CAT#:1731-AL BW 1597-01Size:1 mg

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CAS Number

72235-58-6

MDL Number

MFCD04116008

Purity

0.95

Smiles

NCc1ccc (Cl) c (F) c1

Shipping Conditions

Room temperature, no cold chain required

Chemical Information

(4-Chloro-3-fluorophenyl)methanamine

CAS Number	72235-58-6
PubChem CID	2757541
IUPAC Name	(4-chloro-3-fluorophenyl)methanamine
Molecular Formula	C7H7ClFN
Molecular Weight	159.59
XLogP	1.5
Topological Polar Surface Area	26
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	1
Heavy Atom Count	10
Formal Charge	0
Complexity	110

SMILES

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

InChI

InChI=1S/C7H7ClFN/c8-6-2-1-5(4-10)3-7(6)9/h1-3H,4,10H2

InChIKey

HSNPBYKCCNMQNA-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 72235-58-6

CID: 2757541

Formula: C7H7ClFN

MW: 159.59

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	159.59
XLogP3	1.5
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	1
Exact Mass	159.0251051
Monoisotopic Mass	159.0251051
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
AL BW 0631-01	(3-bromo-4-fluorophenyl) methanamine
AL BW 0314-01	(4-chloro-3-nitrophenyl) methanamine
AL BW 1267-01	[1- (4-fluorophenyl) cyclohexyl]methanamine
AL BW 0957-01	[3-chloro-4- (trifluoromethoxy) phenyl]methanamine
AL BW 1056-01	[3-chloro-4- (trifluoromethyl) phenyl]methanamine
KY UC 3773-01	N- (3-chloro-4-fluorophenyl) propanamide
AL BW 0956-01	2- (3-chloro-4-fluorophenyl) ethanamine
AL BW 0814-01	(2-chloro-4-pyridinyl) methanamine
AL BW 1598-01	(2-chloro-4-methoxyphenyl) methanamine
AL BW 0641-01	[2-[ (4-chlorophenyl) methoxy]-6-fluorophenyl]methanamine

Catalog	Name
VAC56904-01	(3-Chloro-4-fluorophenyl) (cyclopropyl) methanamine
CTC82128-01	(4-Chloro-3-fluorophenyl) (phenyl) methanamine
RPD14134-01	(3-Chloro-4-fluorophenyl) (phenyl) methanamine hydrochloride
PC906725-01	(2-Chloro-3-fluorophenyl) methanamine
UQB46246-01	(2-Chloro-4-fluorophenyl) (4-methylphenyl) methanamine
QCC36851-01	[4- (2-Chloro-4-nitrophenoxy) -3-fluorophenyl]methanamine hydrochloride
RDC31854-01	(3-Chloro-2-fluorophenyl) (phenyl) methanamine
RG-F122152-01	(4-Fluorophenyl) Methanamine
SDC00475-01	[1- (2-Chloro-4-fluorophenyl) cyclopropyl]methanamine
PC1003892-01	(1- (2-Chloro-4-fluorophenyl) cyclopropyl) methanamine