Home Halogens 2-(4-chlorophenyl)-2-(pyrrolidin-1-yl)acetic acid hydrochloride

2-(4-chlorophenyl)-2-(pyrrolidin-1-yl)acetic acid hydrochloride

CAS No.:
1956309-54-8
Catalog Number:
AG01DILO
Molecular Formula:
C12H15Cl2NO2
Molecular Weight:
276.1590
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Product Description
Catalog Number:
AG01DILO
Chemical Name:
2-(4-chlorophenyl)-2-(pyrrolidin-1-yl)acetic acid hydrochloride
CAS Number:
1956309-54-8
Molecular Formula:
C12H15Cl2NO2
Molecular Weight:
276.1590
MDL Number:
MFCD28991771
IUPAC Name:
2-(4-chlorophenyl)-2-pyrrolidin-1-ylacetic acid;hydrochloride
InChI:
InChI=1S/C12H14ClNO2.ClH/c13-10-5-3-9(4-6-10)11(12(15)16)14-7-1-2-8-14;/h3-6,11H,1-2,7-8H2,(H,15,16);1H
InChI Key:
AMFZZTMSJMAOSD-UHFFFAOYSA-N
SMILES:
OC(=O)C(c1ccc(cc1)Cl)N1CCCC1.Cl
Properties
Complexity:
245  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
275.048g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
276.157g/mol
Monoisotopic Mass:
275.048g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties