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Home Other Building Blocks 2-phenyl-3-(pyrrolidin-1-yl)propanoic acid hydrochloride

2-phenyl-3-(pyrrolidin-1-yl)propanoic acid hydrochloride

CAS No.:
1338795-41-7
Catalog Number:
AG01BAHW
Molecular Formula:
C13H18ClNO2
Molecular Weight:
255.7405
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Product Description
Catalog Number:
AG01BAHW
Chemical Name:
2-phenyl-3-(pyrrolidin-1-yl)propanoic acid hydrochloride
CAS Number:
1338795-41-7
Molecular Formula:
C13H18ClNO2
Molecular Weight:
255.7405
MDL Number:
MFCD28397661
IUPAC Name:
2-phenyl-3-pyrrolidin-1-ylpropanoic acid;hydrochloride
InChI:
InChI=1S/C13H17NO2.ClH/c15-13(16)12(10-14-8-4-5-9-14)11-6-2-1-3-7-11;/h1-3,6-7,12H,4-5,8-10H2,(H,15,16);1H
InChI Key:
ZTHAILBJAGBDTB-UHFFFAOYSA-N
SMILES:
OC(=O)C(c1ccccc1)CN1CCCC1.Cl
Properties
Complexity:
230  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
255.103g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
255.742g/mol
Monoisotopic Mass:
255.103g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties