200,000+ products from a single source!
sales@angenechem.com
140623-61-6 | 2(3H)-Benzoxazolone, 6-(4-hydroxy-1-oxobutyl)-
CAS No: 140623-61-6 Catalog No: AG001CKY MDL No:
Product Description
Catalog Number:
AG001CKY
Chemical Name:
2(3H)-Benzoxazolone, 6-(4-hydroxy-1-oxobutyl)-
CAS Number:
140623-61-6
Molecular Formula:
C11H11NO4
Molecular Weight:
221.2093
IUPAC Name:
6-(4-hydroxybutanoyl)-3H-1,3-benzoxazol-2-one
InChI:
InChI=1S/C11H11NO4/c13-5-1-2-9(14)7-3-4-8-10(6-7)16-11(15)12-8/h3-4,6,13H,1-2,5H2,(H,12,15)
InChI Key:
FTFLZRWOEFYRJR-UHFFFAOYSA-N
SMILES:
OCCCC(=O)c1ccc2c(c1)oc(=O)[nH]2
Properties
Complexity:
292
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
221.069g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
221.212g/mol
Monoisotopic Mass:
221.069g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
75.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.