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85908-96-9 | N-Boc-2-Piperidone
CAS No: 85908-96-9 Catalog No: AG0035CK MDL No:MFCD02179046
Product Description
Catalog Number:
AG0035CK
Chemical Name:
N-Boc-2-Piperidone
CAS Number:
85908-96-9
Molecular Formula:
C10H17NO3
Molecular Weight:
199.2469
MDL Number:
MFCD02179046
IUPAC Name:
tert-butyl 2-oxopiperidine-1-carboxylate
InChI:
InChI=1S/C10H17NO3/c1-10(2,3)14-9(13)11-7-5-4-6-8(11)12/h4-7H2,1-3H3
InChI Key:
ULMHMJAEGZPQRY-UHFFFAOYSA-N
SMILES:
O=C1CCCCN1C(=O)OC(C)(C)C
EC Number:
617-775-1
Properties
Complexity:
242
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:
0
Isotope Atom Count:
0
Molecular Weight:
199.25g/mol
Monoisotopic Mass:
199.121g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
46.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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