CAS No.496807-97-7,3,3-DIFLUOROPIPERIDINE HYDROCHLORIDE Suppliers

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Basic Information

Molecular Structure:
CAS No.:	496807-97-7
Name:	3,3-DIFLUOROPIPERIDINE HYDROCHLORIDE

Formula:	C₅H₁₀ClF₂N
Molecular Weight:	157.591
Synonyms:	Piperidine,3,3-difluoro-, hydrochloride (9CI);3,3-Difluoropiperidine hydrochloride;
EINECS:	-0
Melting Point:	243-247 °C
Boiling Point:	114.3oC at 760mmHg
Flash Point:	22.9oC
Hazard Symbols:	Xi
Risk Codes:	36/37/38
Safety:	26
PSA:	12.03000
LogP:	2.13590

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Specification

The Piperidine,3,3-difluoro-, hydrochloride (1:1), with the CAS registry number 496807-97-7, has the systematic name of 3,3-difluoropiperidine hydrochloride. It belongs to the following product categories: Building Blocks; Heterocyclic Building Blocks; Piperidines. And the molecular formula of the chemical is C₅H₁₀ClF₂N.

The characteristics of Piperidine,3,3-difluoro-, hydrochloride (1:1) are as followings: (1)H-Bond Donor 2; (2)H-Bond Acceptor 3; (3)Rotatable Bond Count 0; (4)Exact Mass 157.046983; (5)MonoIsotopic Mass 157.046983; (6)Topological Polar Surface Area 12; (7)Heavy Atom Count 9; (8)Formal Charge 0; (9)Complexity 82.5; (10)Isotope Atom Count 0; (11)Defined Atom StereoCenter Count 0; (12)Undefined Atom StereoCenter Count 0; (13)Defined Bond StereoCenter Count 0; (14)Undefined Bond StereoCenter Count 0; (15)Covalently-Bonded Unit Count 2.

You should be cautious while dealing with this chemical. It irritates to eyes, respiratory system and skin. Therefore, you had better take the following instructions: If in case of contacting with eyes, rinse immediately with plenty of water and seek medical advice.

Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: C1CC(CNC1)(F)F.Cl
(2)InChI: InChI=1/C5H9F2N.ClH/c6-5(7)2-1-3-8-4-5;/h8H,1-4H2;1H
(3)InChIKey: LEHHIPIDKQVNEV-UHFFFAOYAH