200,000+ products from a single source!
sales@angenechem.com
88518-94-9 | 7H-Pyrano[3,2-e]benzoxazol-7-one, 9-methyl-2-(methylthio)-
CAS No: 88518-94-9 Catalog No: AG008A0C MDL No:
Product Description
Catalog Number:
AG008A0C
Chemical Name:
7H-Pyrano[3,2-e]benzoxazol-7-one, 9-methyl-2-(methylthio)-
CAS Number:
88518-94-9
Molecular Formula:
C12H9NO3S
Molecular Weight:
247.2698
IUPAC Name:
9-methyl-2-methylsulfanylpyrano[3,2-e][1,3]benzoxazol-7-one
InChI:
InChI=1S/C12H9NO3S/c1-6-5-9(14)15-7-3-4-8-11(10(6)7)13-12(16-8)17-2/h3-5H,1-2H3
InChI Key:
DLZRFZYAZGBRNH-UHFFFAOYSA-N
SMILES:
CSc1oc2c(n1)c1c(C)cc(=O)oc1cc2
Properties
Complexity:
371
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
247.03g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
247.268g/mol
Monoisotopic Mass:
247.03g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
77.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.