200,000+ products from a single source!
sales@angenechem.com
89441-11-2 | 4H-3,1-Benzoxazin-4-one, 2-(methoxymethyl)-8-(trifluoromethyl)-
CAS No: 89441-11-2 Catalog No: AG0044O5 MDL No:
Product Description
Catalog Number:
AG0044O5
Chemical Name:
4H-3,1-Benzoxazin-4-one, 2-(methoxymethyl)-8-(trifluoromethyl)-
CAS Number:
89441-11-2
Molecular Formula:
C11H8F3NO3
Molecular Weight:
259.1813
IUPAC Name:
2-(methoxymethyl)-8-(trifluoromethyl)-3,1-benzoxazin-4-one
InChI:
InChI=1S/C11H8F3NO3/c1-17-5-8-15-9-6(10(16)18-8)3-2-4-7(9)11(12,13)14/h2-4H,5H2,1H3
InChI Key:
YMXNUJSNDMTOCU-UHFFFAOYSA-N
SMILES:
COCc1oc(=O)c2c(n1)c(ccc2)C(F)(F)F
Properties
Complexity:
367
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
259.046g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
259.184g/mol
Monoisotopic Mass:
259.046g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
47.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.