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1593-24-4 | 2-Propenoic acid, 3-(2-quinoxalinyl)-
CAS No: 1593-24-4 Catalog No: AG001QLM MDL No:
Product Description
Catalog Number:
AG001QLM
Chemical Name:
2-Propenoic acid, 3-(2-quinoxalinyl)-
CAS Number:
1593-24-4
Molecular Formula:
C11H8N2O2
Molecular Weight:
200.1934
IUPAC Name:
(E)-3-quinoxalin-2-ylprop-2-enoic acid
InChI:
InChI=1S/C11H8N2O2/c14-11(15)6-5-8-7-12-9-3-1-2-4-10(9)13-8/h1-7H,(H,14,15)/b6-5+
InChI Key:
QJNZVVWLYVQBPQ-AATRIKPKSA-N
SMILES:
OC(=O)C=Cc1cnc2c(n1)cccc2
NSC Number:
158311
Properties
Complexity:
265
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
200.059g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
200.197g/mol
Monoisotopic Mass:
200.059g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
63.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
Literature
| Title | Journal |
|---|---|
| Microsphere-based protease assays and screening application for lethal factor and factor Xa. | Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501 |
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