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157649-29-1 | 4-Piperidinepropanoic acid, 1-(methoxycarbonyl)-
CAS No: 157649-29-1 Catalog No: AG001PKW MDL No:
Product Description
Catalog Number:
AG001PKW
Chemical Name:
4-Piperidinepropanoic acid, 1-(methoxycarbonyl)-
CAS Number:
157649-29-1
Molecular Formula:
C10H17NO4
Molecular Weight:
215.2463
IUPAC Name:
3-(1-methoxycarbonylpiperidin-4-yl)propanoic acid
InChI:
InChI=1S/C10H17NO4/c1-15-10(14)11-6-4-8(5-7-11)2-3-9(12)13/h8H,2-7H2,1H3,(H,12,13)
InChI Key:
VFYIKWMHUOXSDY-UHFFFAOYSA-N
SMILES:
COC(=O)N1CCC(CC1)CCC(=O)O
Properties
Complexity:
234
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
215.116g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
215.249g/mol
Monoisotopic Mass:
215.116g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
66.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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