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Home > Other Heterocycles > 1820687-31-7
1820687-31-7 | 3-cyclopropyl-5-oxa-2-azaspiro[3.4]octan-1-one, Mixture of diastereomers
CAS No: 1820687-31-7 Catalog No: AG01ALZX MDL No:MFCD29033867
Product Description
Catalog Number:
AG01ALZX
Chemical Name:
3-cyclopropyl-5-oxa-2-azaspiro[3.4]octan-1-one, Mixture of diastereomers
CAS Number:
1820687-31-7
Molecular Formula:
C9H13NO2
Molecular Weight:
167.2050
MDL Number:
MFCD29033867
IUPAC Name:
1-cyclopropyl-5-oxa-2-azaspiro[3.4]octan-3-one
InChI:
InChI=1S/C9H13NO2/c11-8-9(4-1-5-12-9)7(10-8)6-2-3-6/h6-7H,1-5H2,(H,10,11)
InChI Key:
PIPPXYYKUIIFFE-UHFFFAOYSA-N
SMILES:
O=C1NC(C21CCCO2)C1CC1
Properties
Complexity:
237
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
167.095g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
167.208g/mol
Monoisotopic Mass:
167.095g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
38.3A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4
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