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25393-20-8 | 1-ACETYL-2-PIPERIDINEACETIC ACID
CAS No: 25393-20-8 Catalog No: AG003DWC MDL No:MFCD12784528
Product Description
Catalog Number:
AG003DWC
Chemical Name:
1-ACETYL-2-PIPERIDINEACETIC ACID
CAS Number:
25393-20-8
Molecular Formula:
C9H15NO3
Molecular Weight:
185.2203
MDL Number:
MFCD12784528
IUPAC Name:
2-(1-acetylpiperidin-2-yl)acetic acid
InChI:
InChI=1S/C9H15NO3/c1-7(11)10-5-3-2-4-8(10)6-9(12)13/h8H,2-6H2,1H3,(H,12,13)
InChI Key:
FMJUSBGJDLWLGD-UHFFFAOYSA-N
SMILES:
OC(=O)CC1CCCCN1C(=O)C
Properties
Complexity:
215
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
185.105g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
185.223g/mol
Monoisotopic Mass:
185.105g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
57.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1
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