Home Halogens 3-[(3-chlorophenyl)sulfanyl]pyrrolidine hydrochloride

3-[(3-chlorophenyl)sulfanyl]pyrrolidine hydrochloride

CAS No.:
1803602-21-2
Catalog Number:
AG01ALL4
Molecular Formula:
C10H13Cl2NS
Molecular Weight:
250.1879
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Product Description
Catalog Number:
AG01ALL4
Chemical Name:
3-[(3-chlorophenyl)sulfanyl]pyrrolidine hydrochloride
CAS Number:
1803602-21-2
Molecular Formula:
C10H13Cl2NS
Molecular Weight:
250.1879
MDL Number:
MFCD28954395
IUPAC Name:
3-(3-chlorophenyl)sulfanylpyrrolidine;hydrochloride
InChI:
InChI=1S/C10H12ClNS.ClH/c11-8-2-1-3-9(6-8)13-10-4-5-12-7-10;/h1-3,6,10,12H,4-5,7H2;1H
InChI Key:
CSWDKOFZUVCZCD-UHFFFAOYSA-N
SMILES:
Clc1cccc(c1)SC1CNCC1.Cl
Properties
Complexity:
165  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
249.015g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
250.181g/mol
Monoisotopic Mass:
249.015g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties