200,000+ products from a single source!
sales@angenechem.com
118590-09-3 | 2-Propenoic acid, 2-methyl-, (2-thioxo-3(2H)-benzoxazolyl)methyl ester
CAS No: 118590-09-3 Catalog No: AG007677 MDL No:
Product Description
Catalog Number:
AG007677
Chemical Name:
2-Propenoic acid, 2-methyl-, (2-thioxo-3(2H)-benzoxazolyl)methyl ester
CAS Number:
118590-09-3
Molecular Formula:
C12H11NO3S
Molecular Weight:
249.2856
IUPAC Name:
(2-sulfanylidene-1,3-benzoxazol-3-yl)methyl 2-methylprop-2-enoate
InChI:
InChI=1S/C12H11NO3S/c1-8(2)11(14)15-7-13-9-5-3-4-6-10(9)16-12(13)17/h3-6H,1,7H2,2H3
InChI Key:
UZZISSKLJABBDF-UHFFFAOYSA-N
SMILES:
CC(=C)C(=O)OCn1c(=S)oc2c1cccc2
Properties
Complexity:
356
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
249.046g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
249.284g/mol
Monoisotopic Mass:
249.046g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
70.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.