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17281-11-7 | 3-cyclopropyl-4,5-dihydro-1,2-oxazol-5-one
CAS No: 17281-11-7 Catalog No: AG01C4N7 MDL No:MFCD18909443
Product Description
Catalog Number:
AG01C4N7
Chemical Name:
3-cyclopropyl-4,5-dihydro-1,2-oxazol-5-one
CAS Number:
17281-11-7
Molecular Formula:
C6H7NO2
Molecular Weight:
125.1253
MDL Number:
MFCD18909443
IUPAC Name:
3-cyclopropyl-4H-1,2-oxazol-5-one
InChI:
InChI=1S/C6H7NO2/c8-6-3-5(7-9-6)4-1-2-4/h4H,1-3H2
InChI Key:
ZQNWHKVSUWIRPR-UHFFFAOYSA-N
SMILES:
O=C1ON=C(C1)C1CC1
Properties
Complexity:
182
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
125.048g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
125.127g/mol
Monoisotopic Mass:
125.048g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
38.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
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