200,000+ products from a single source!
sales@angenechem.com
Home > Other Building Blocks > 861841-80-7
861841-80-7 | 2H-3,1-Benzoxazin-2-one, 4-ethyl-1,4-dihydro-
CAS No: 861841-80-7 Catalog No: AG004TIU MDL No:
Product Description
Catalog Number:
AG004TIU
Chemical Name:
2H-3,1-Benzoxazin-2-one, 4-ethyl-1,4-dihydro-
CAS Number:
861841-80-7
Molecular Formula:
C10H11NO2
Molecular Weight:
177.1998
IUPAC Name:
4-ethyl-1,4-dihydro-3,1-benzoxazin-2-one
InChI:
InChI=1S/C10H11NO2/c1-2-9-7-5-3-4-6-8(7)11-10(12)13-9/h3-6,9H,2H2,1H3,(H,11,12)
InChI Key:
PQTISLNPNJSVLM-UHFFFAOYSA-N
SMILES:
CCC1OC(=O)Nc2c1cccc2
Properties
Complexity:
205
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
177.079g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
177.203g/mol
Monoisotopic Mass:
177.079g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
38.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.