[4- (4-Chlorophenyl) -2-fluorophenyl]methanamine

CAT: 0926-DXB95891-01Size: 50 mgDry Ice: NoHazardous: No

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CAT#:0926-DXB95891-01Size:50 mg

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CAS Number

1178958-91-2

MDL Number

MFCD12824218

Smiles

C1=CC (=CC=C1C2=CC (=C (C=C2) CN) F) Cl

Molecular Formula

C13H11ClFN

Molecular Weight

235.68 g/mol

Controlled

Chemical Information

[4-(4-Chlorophenyl)-2-fluorophenyl]methanamine

CAS Number	1178958-91-2
PubChem CID	61026033
IUPAC Name	[4-(4-chlorophenyl)-2-fluorophenyl]methanamine
Molecular Formula	C13H11ClFN
Molecular Weight	235.68
XLogP	3.1
Topological Polar Surface Area	26
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	2
Heavy Atom Count	16
Formal Charge	0
Complexity	216

SMILES

C1=CC(=CC=C1C2=CC(=C(C=C2)CN)F)Cl

InChI

InChI=1S/C13H11ClFN/c14-12-5-3-9(4-6-12)10-1-2-11(8-16)13(15)7-10/h1-7H,8,16H2

InChIKey

GBTAMJDKRXHUDH-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 1178958-91-2

CID: 61026033

Formula: C13H11ClFN

MW: 235.68

Interactive 3D Structure

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Computed Properties

Property	Value
Molecular Weight	235.68
XLogP3	3.1
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	2
Exact Mass	235.0564052
Monoisotopic Mass	235.0564052
Topological Polar Surface Area	26 Å²
Heavy Atom Count	16
Formal Charge	0
Complexity	216
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
RQB74807-01	(4-Chlorophenyl) (2-fluorophenyl) methanamine
RQB50827-01	(4-Chlorophenyl) (4-fluorophenyl) methanamine
EGA23341-01	(2-Chlorophenyl) (4-fluorophenyl) methanamine hydrochloride
RQB72928-01	(4-Chlorophenyl) (3-fluorophenyl) methanamine
RQB50675-01	(3-Chlorophenyl) (4-fluorophenyl) methanamine
AZB57791-01	(3-Chlorophenyl) (2-fluorophenyl) methanamine
IDC67658-01	(2-Chlorophenyl) (4-chlorophenyl) methanamine hydrochloride
UQB35569-01	(4-Chlorophenyl) (2-methylphenyl) methanamine
WQB12649-01	(2-Chlorophenyl) (4-ethylphenyl) methanamine
WFB57432	(4-Bromo-2-chlorophenyl) methanamine

Catalog	Name
sc-342586	(2-chlorophenyl) (4-fluorophenyl) methanamine hydrochloride
AL BW 0641-01	[2-[ (4-chlorophenyl) methoxy]-6-fluorophenyl]methanamine
RG-F122152-01	(4-Fluorophenyl) Methanamine
OR1055337-01	(2-Bromo-4-chlorophenyl) methanamine
AL BW 2448-01	(4-bromo-2-chlorophenyl) methanamine
PC100065-01	(2-Bromo-4-fluorophenyl) methanamine
sc-342587	(2-chlorophenyl) (4-fluorophenyl) methanone
RG-A263022-01	(4-Chlorophenyl) (Phenyl) Methanamine
OR1008165-01	(4-Chlorophenyl) Methanamine Hydrochloride
PC103849	(4-Fluorophenyl) methanamine hydrochloride