200,000+ products from a single source!
sales@angenechem.com
Home > Other Building Blocks > 16323-43-6
16323-43-6 | 2-Propenoic acid, 3,3'-(1,4-phenylene)bis-
CAS No: 16323-43-6 Catalog No: AG001TXR MDL No:MFCD00002698
Product Description
Catalog Number:
AG001TXR
Chemical Name:
2-Propenoic acid, 3,3'-(1,4-phenylene)bis-
CAS Number:
16323-43-6
Molecular Formula:
C12H10O4
Molecular Weight:
218.2054
MDL Number:
MFCD00002698
IUPAC Name:
(E)-3-[4-[(E)-2-carboxyethenyl]phenyl]prop-2-enoic acid
InChI:
InChI=1S/C12H10O4/c13-11(14)7-5-9-1-2-10(4-3-9)6-8-12(15)16/h1-8H,(H,13,14)(H,15,16)/b7-5+,8-6+
InChI Key:
AAFXQFIGKBLKMC-KQQUZDAGSA-N
SMILES:
OC(=O)C=Cc1ccc(cc1)C=CC(=O)O
EC Number:
240-399-0
UNII:
0F7E4O8Q8Y
NSC Number:
133919
Properties
Complexity:
277
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
2
Exact Mass:
218.058g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
218.208g/mol
Monoisotopic Mass:
218.058g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
74.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
Literature
| Title | Journal |
|---|---|
| Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. | Bioorganic & medicinal chemistry letters 20101101 |
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.