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Home > Other Heterocycles > 1870091-13-6
1870091-13-6 | 3-(propan-2-yl)-2-azaspiro[3.4]octan-1-one
CAS No: 1870091-13-6 Catalog No: AG01C1HO MDL No:MFCD29047310
Product Description
Catalog Number:
AG01C1HO
Chemical Name:
3-(propan-2-yl)-2-azaspiro[3.4]octan-1-one
CAS Number:
1870091-13-6
Molecular Formula:
C10H17NO
Molecular Weight:
167.2481
MDL Number:
MFCD29047310
IUPAC Name:
1-propan-2-yl-2-azaspiro[3.4]octan-3-one
InChI:
InChI=1S/C10H17NO/c1-7(2)8-10(9(12)11-8)5-3-4-6-10/h7-8H,3-6H2,1-2H3,(H,11,12)
InChI Key:
GQLVLYDHEIOTQD-UHFFFAOYSA-N
SMILES:
CC(C1NC(=O)C21CCCC2)C
Properties
Complexity:
204
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
167.131g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
167.252g/mol
Monoisotopic Mass:
167.131g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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