Home Carboxys 1,2-Pyrrolidinedicarboxylicacid,1-methylester(9CI)

1,2-Pyrrolidinedicarboxylicacid,1-methylester(9CI)

CAS No.:
134250-76-3
Catalog Number:
AG007MFV
Molecular Formula:
C7H11NO4
Molecular Weight:
173.1665
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Product Description
Catalog Number:
AG007MFV
Chemical Name:
1,2-Pyrrolidinedicarboxylicacid,1-methylester(9CI)
CAS Number:
134250-76-3
Molecular Formula:
C7H11NO4
Molecular Weight:
173.1665
MDL Number:
MFCD11128972
IUPAC Name:
1-methoxycarbonylpyrrolidine-2-carboxylic acid
InChI:
InChI=1S/C7H11NO4/c1-12-7(11)8-4-2-3-5(8)6(9)10/h5H,2-4H2,1H3,(H,9,10)
InChI Key:
PNXXTNFAEIJNDV-UHFFFAOYSA-N
SMILES:
COC(=O)N1CCCC1C(=O)O
Properties
Complexity:
204  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
173.069g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
173.168g/mol
Monoisotopic Mass:
173.069g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
66.8A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5  
Properties