3- (3,4-Difluorophenyl) piperidine

CAT: 0926-DYB79894-01Size: 100 mgDry Ice: NoHazardous: No

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CAT#:0926-DYB79894-01Size:100 mg

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CAS Number

1203798-94-0

MDL Number

MFCD19348664

Smiles

C1CC (CNC1) C2=CC (=C (C=C2) F) F

Molecular Formula

C11H13F2N

Molecular Weight

197.22 g/mol

Controlled

Chemical Information

3-(3,4-Difluorophenyl)piperidine

CAS Number	1203798-94-0
PubChem CID	64458001
IUPAC Name	3-(3,4-difluorophenyl)piperidine
Molecular Formula	C11H13F2N
Molecular Weight	197.22
XLogP	2.2
Topological Polar Surface Area	12
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	1
Heavy Atom Count	14
Formal Charge	0
Complexity	186

SMILES

C1CC(CNC1)C2=CC(=C(C=C2)F)F

InChI

InChI=1S/C11H13F2N/c12-10-4-3-8(6-11(10)13)9-2-1-5-14-7-9/h3-4,6,9,14H,1-2,5,7H2

InChIKey

XFGMGVZQXXIXGX-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 1203798-94-0

CID: 64458001

Formula: C11H13F2N

MW: 197.22

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	197.22
XLogP3	2.2
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	1
Exact Mass	197.10160574
Monoisotopic Mass	197.10160574
Topological Polar Surface Area	12 Å²
Heavy Atom Count	14
Formal Charge	0
Complexity	186
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
MKA27256-01	4- (3,4-Difluorophenyl) piperidine
EQB85269-01	4- (2,3-Difluorophenyl) piperidine
EQB61890-01	4- (2,3-difluorophenyl) piperidine hydrochloride
UGB50098-01	4-[ (3,5-Difluorophenyl) methyl]piperidine
BAC14450-01	3-[ (2,4-Difluorophenyl) sulfanyl]piperidine
DXC58397-01	4-[ (3,4-Difluorophenyl) methylidene]piperidine hydrochloride
JBD32582-01	4-[ (2,3-Difluorophenyl) methyl]piperidine hydrochloride
AZB68778-01	3-[ (3,5-Difluorophenyl) methyl]piperidine
URB76890-01	3- (2,5-Difluorophenyl) piperidine
UQB37370-01	4- (2,6-Difluorophenyl) piperidine

Catalog	Name
PC402125	4- (3,4-Difluorophenyl) piperidine hydrochloride
PC53425	4-[2- (3,4-difluorophenyl) ethyl]piperidine
sc-267060	4- (2,4-Difluorophenyl) piperidine
PC402114	3- (3,5-Difluorophenyl) piperidine
sc-315380	4-[2- (3,5-Difluorophenyl) ethyl]piperidine
407681-01	1- (2,4-Difluorophenyl) piperidine
sc-338827A	1-[ (3,4-difluorophenyl) sulfonyl]piperidine-4-carboxylic acid
PC1003309-01	1- ((2,4-Difluorophenyl) carbamoyl) piperidine-3-carboxylic acid
sc-348544	4-[ (2,5-difluorophenyl) carbonyl]piperidine hydrochloride
sc-506627	(S) -2- (3,5-Difluorophenyl) piperidine hydrochloride