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Home > Other Heterocycles > 1955541-44-2
1955541-44-2 | 6,6-dimethoxy-3-(propan-2-yl)-2-azaspiro[3.3]heptan-1-one
CAS No: 1955541-44-2 Catalog No: AG01B2MT MDL No:MFCD29991668
Product Description
Catalog Number:
AG01B2MT
Chemical Name:
6,6-dimethoxy-3-(propan-2-yl)-2-azaspiro[3.3]heptan-1-one
CAS Number:
1955541-44-2
Molecular Formula:
C11H19NO3
Molecular Weight:
213.2735
MDL Number:
MFCD29991668
IUPAC Name:
6,6-dimethoxy-1-propan-2-yl-2-azaspiro[3.3]heptan-3-one
InChI:
InChI=1S/C11H19NO3/c1-7(2)8-10(9(13)12-8)5-11(6-10,14-3)15-4/h7-8H,5-6H2,1-4H3,(H,12,13)
InChI Key:
BQUXVLLODVUBOL-UHFFFAOYSA-N
SMILES:
COC1(OC)CC2(C1)C(=O)NC2C(C)C
Properties
Complexity:
276
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
213.136g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
213.277g/mol
Monoisotopic Mass:
213.136g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
47.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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