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10581-38-1 | 2,2,6,6-Tetramethyl-4-piperidone Hydrate
CAS No: 10581-38-1 Catalog No: AG003F8P MDL No:MFCD00149393
Product Description
Catalog Number:
AG003F8P
Chemical Name:
2,2,6,6-Tetramethyl-4-piperidone Hydrate
CAS Number:
10581-38-1
Molecular Formula:
C9H19NO2
Molecular Weight:
173.2527
MDL Number:
MFCD00149393
IUPAC Name:
2,2,6,6-tetramethylpiperidin-4-one;hydrate
InChI:
InChI=1S/C9H17NO.H2O/c1-8(2)5-7(11)6-9(3,4)10-8;/h10H,5-6H2,1-4H3;1H2
InChI Key:
SFDODBGIDPNFEH-UHFFFAOYSA-N
SMILES:
O=C1CC(C)(C)NC(C1)(C)C.O
Properties
Complexity:
164
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
173.142g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
173.256g/mol
Monoisotopic Mass:
173.142g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
30.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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