Home Other Building Blocks 2-{2-[(4-Chlorophenyl)sulfanyl]ethyl}piperidine hydrochloride

2-{2-[(4-Chlorophenyl)sulfanyl]ethyl}piperidine hydrochloride

CAS No.:
1177283-58-7
Catalog Number:
AG01AS3G
Molecular Formula:
C13H19Cl2NS
Molecular Weight:
292.2677
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Product Description
Catalog Number:
AG01AS3G
Chemical Name:
2-{2-[(4-Chlorophenyl)sulfanyl]ethyl}piperidine hydrochloride
CAS Number:
1177283-58-7
Molecular Formula:
C13H19Cl2NS
Molecular Weight:
292.2677
MDL Number:
MFCD08166271
IUPAC Name:
2-[2-(4-chlorophenyl)sulfanylethyl]piperidine;hydrochloride
InChI:
InChI=1S/C13H18ClNS.ClH/c14-11-4-6-13(7-5-11)16-10-8-12-3-1-2-9-15-12;/h4-7,12,15H,1-3,8-10H2;1H
InChI Key:
NWBPHVBAKSEFPM-UHFFFAOYSA-N
SMILES:
Clc1ccc(cc1)SCCC1CCCCN1.Cl
Properties
Complexity:
192  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
291.062g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
292.262g/mol
Monoisotopic Mass:
291.062g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties