Home Carboxys 1-benzyl-4-(propan-2-yl)pyrrolidine-3-carboxylic acid hydrochloride

1-benzyl-4-(propan-2-yl)pyrrolidine-3-carboxylic acid hydrochloride

CAS No.:
2095410-72-1
Catalog Number:
AG01BXPR
Molecular Formula:
C15H22ClNO2
Molecular Weight:
283.7937
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Product Description
Catalog Number:
AG01BXPR
Chemical Name:
1-benzyl-4-(propan-2-yl)pyrrolidine-3-carboxylic acid hydrochloride
CAS Number:
2095410-72-1
Molecular Formula:
C15H22ClNO2
Molecular Weight:
283.7937
MDL Number:
MFCD30730467
IUPAC Name:
1-benzyl-4-propan-2-ylpyrrolidine-3-carboxylic acid;hydrochloride
InChI:
InChI=1S/C15H21NO2.ClH/c1-11(2)13-9-16(10-14(13)15(17)18)8-12-6-4-3-5-7-12;/h3-7,11,13-14H,8-10H2,1-2H3,(H,17,18);1H
InChI Key:
OVFWQGHCPONOGO-UHFFFAOYSA-N
SMILES:
CC(C1CN(CC1C(=O)O)Cc1ccccc1)C.Cl
Properties
Complexity:
284  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
283.134g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
283.796g/mol
Monoisotopic Mass:
283.134g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
Properties