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131417-49-7 | 4-Piperidinepropanoic acid, 1-acetyl-
CAS No: 131417-49-7 Catalog No: AG000W56 MDL No:MFCD14706194
Product Description
Catalog Number:
AG000W56
Chemical Name:
4-Piperidinepropanoic acid, 1-acetyl-
CAS Number:
131417-49-7
Molecular Formula:
C10H17NO3
Molecular Weight:
199.2469
MDL Number:
MFCD14706194
IUPAC Name:
3-(1-acetylpiperidin-4-yl)propanoic acid
InChI:
InChI=1S/C10H17NO3/c1-8(12)11-6-4-9(5-7-11)2-3-10(13)14/h9H,2-7H2,1H3,(H,13,14)
InChI Key:
CBWPIRBWBJQAPM-UHFFFAOYSA-N
SMILES:
OC(=O)CCC1CCN(CC1)C(=O)C
Properties
Complexity:
219
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
199.121g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
199.25g/mol
Monoisotopic Mass:
199.121g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
57.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3
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