2- (3,4-Difluorophenyl) propan-2-amine

CAT: 0926-GMA76117-01Size: 250 mgDry Ice: NoHazardous: No

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CAT#:0926-GMA76117-01Size:250 mg

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CAS Number

306761-17-1

MDL Number

MFCD13189642

Smiles

CC (C) (C1=CC (=C (C=C1) F) F) N

Molecular Formula

C9H11F2N

Molecular Weight

171.19 g/mol

Controlled

Chemical Information

2-(3,4-Difluorophenyl)propan-2-amine

CAS Number	306761-17-1
PubChem CID	57685637
IUPAC Name	2-(3,4-difluorophenyl)propan-2-amine
Molecular Formula	C9H11F2N
Molecular Weight	171.19
XLogP	1.6
Topological Polar Surface Area	26
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	1
Heavy Atom Count	12
Formal Charge	0
Complexity	159

SMILES

CC(C)(C1=CC(=C(C=C1)F)F)N

InChI

InChI=1S/C9H11F2N/c1-9(2,12)6-3-4-7(10)8(11)5-6/h3-5H,12H2,1-2H3

InChIKey

BKEJWQVDJHFFAD-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 306761-17-1

CID: 57685637

Formula: C9H11F2N

MW: 171.19

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	171.19
XLogP3	1.6
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	1
Exact Mass	171.08595568
Monoisotopic Mass	171.08595568
Topological Polar Surface Area	26 Å²
Heavy Atom Count	12
Formal Charge	0
Complexity	159
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
WTB79045-01	2- (3,4-Difluorophenyl) propan-1-amine
CAA02164-01	1- (2,4-Difluorophenyl) propan-2-amine
WTB81588-01	2- (2,4-Difluorophenyl) propan-1-amine
YZA14341-01	1- (2,4-Difluorophenyl) propan-1-amine
WQB09166-01	[ (2,4-Difluorophenyl) methyl] (propan-2-yl) amine
AZB51994-01	2- (3,5-Difluorophenyl) propan-1-amine
FAC30624	1- (2,3-Difluorophenyl) propan-1-amine
RPD13075-01	1- (2,4-Difluorophenyl) -3- (methylsulfanyl) propan-2-amine hydrochloride
XZB85272-01	[1- (2,4-Difluorophenyl) propan-2-yl] (methyl) amine
TPD51298-01	[2- (2,4-Difluorophenyl) ethyl] (propan-2-yl) amine hydrochloride

Catalog	Name
PC1004447-01	2- (3,4-Difluorophenyl) propan-2-amine
PC1005356-01	2- (3,4-Difluorophenyl) propan-2-amine hydrochloride
PC1004815-01	2- (3,5-Difluorophenyl) propan-2-amine
PC110424-01	1- (2,3-Difluorophenyl) propan-1-amine
PC201015-01	2- (3,5-Difluorophenyl) propan-2-amine hydrochloride
PC1002559-01	1- (3,4-Difluorophenyl) propan-1-amine hydrochloride
PC1012633	2- (3,4-difluorophenyl) propan-2-ol
PC1004685-01	(R) -1- (3,4-Difluorophenyl) propan-1-amine hydrochloride
PC1006965-01	(S) -1- (3,4-Difluorophenyl) propan-1-amine hydrochloride
sc-332471A	1- (2,6-difluorophenyl) propan-2-amine hydrochloride