200,000+ products from a single source!
sales@angenechem.com
100075-80-7 | 4H-3,1-Benzoxazin-4-one, 2-(propylamino)-
CAS No: 100075-80-7 Catalog No: AG0000TT MDL No:
Product Description
Catalog Number:
AG0000TT
Chemical Name:
4H-3,1-Benzoxazin-4-one, 2-(propylamino)-
CAS Number:
100075-80-7
Molecular Formula:
C11H12N2O2
Molecular Weight:
204.2252
IUPAC Name:
2-(propylamino)-3,1-benzoxazin-4-one
InChI:
InChI=1S/C11H12N2O2/c1-2-7-12-11-13-9-6-4-3-5-8(9)10(14)15-11/h3-6H,2,7H2,1H3,(H,12,13)
InChI Key:
QTUULNVXRXRNIL-UHFFFAOYSA-N
SMILES:
CCCNc1nc2ccccc2c(=O)o1
Properties
Complexity:
276
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
204.09g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
204.229g/mol
Monoisotopic Mass:
204.09g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
50.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.