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Home > Other Heterocycles > 1955556-88-3
1955556-88-3 | tert-butyl N-{3-oxospiro[3.3]heptan-1-yl}carbamate
CAS No: 1955556-88-3 Catalog No: AG01C5QF MDL No:MFCD29991480
Product Description
Catalog Number:
AG01C5QF
Chemical Name:
tert-butyl N-{3-oxospiro[3.3]heptan-1-yl}carbamate
CAS Number:
1955556-88-3
Molecular Formula:
C12H19NO3
Molecular Weight:
225.2842
MDL Number:
MFCD29991480
IUPAC Name:
tert-butyl N-(3-oxospiro[3.3]heptan-1-yl)carbamate
InChI:
InChI=1S/C12H19NO3/c1-11(2,3)16-10(15)13-8-7-9(14)12(8)5-4-6-12/h8H,4-7H2,1-3H3,(H,13,15)
InChI Key:
WAWMGPASQBFAMC-UHFFFAOYSA-N
SMILES:
O=C(OC(C)(C)C)NC1CC(=O)C21CCC2
Properties
Complexity:
326
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
225.136g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
225.288g/mol
Monoisotopic Mass:
225.136g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
55.4A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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