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1150618-37-3

1150618-37-3 | 3-Piperidinepropanoic acid, 6-oxo-

CAS No: 1150618-37-3 Catalog No: AG000FU0 MDL No:MFCD12024506

Product Description

Catalog Number:
AG000FU0
Chemical Name:
3-Piperidinepropanoic acid, 6-oxo-
CAS Number:
1150618-37-3
Molecular Formula:
C8H13NO3
Molecular Weight:
171.1937
MDL Number:
MFCD12024506
IUPAC Name:
3-(6-oxopiperidin-3-yl)propanoic acid
InChI:
InChI=1S/C8H13NO3/c10-7-3-1-6(5-9-7)2-4-8(11)12/h6H,1-5H2,(H,9,10)(H,11,12)
InChI Key:
XHJGXWZMEWCGKP-UHFFFAOYSA-N
SMILES:
OC(=O)CCC1CCC(=O)NC1

Properties

Complexity:
191  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
171.09g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
171.196g/mol
Monoisotopic Mass:
171.09g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
66.4A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.3  

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