200,000+ products from a single source!
sales@angenechem.com
26347-18-2 | 3(2H)-Isoxazolone, 2-methyl-
CAS No: 26347-18-2 Catalog No: AG002SUI MDL No:
Product Description
Catalog Number:
AG002SUI
Chemical Name:
3(2H)-Isoxazolone, 2-methyl-
CAS Number:
26347-18-2
Molecular Formula:
C4H5NO2
Molecular Weight:
99.0880
IUPAC Name:
2-methyl-1,2-oxazol-3-one
InChI:
InChI=1S/C4H5NO2/c1-5-4(6)2-3-7-5/h2-3H,1H3
InChI Key:
JPENACUQEHMSRR-UHFFFAOYSA-N
SMILES:
Cn1occc1=O
Properties
Complexity:
119
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
99.032g/mol
Formal Charge:
0
Heavy Atom Count:
7
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
99.089g/mol
Monoisotopic Mass:
99.032g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.1
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.