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16508-04-6 | Bicyclo[2.2.1]hept-2-ene-2,3-dicarboxylic acid
CAS No: 16508-04-6 Catalog No: AG001V9L MDL No:
Product Description
Catalog Number:
AG001V9L
Chemical Name:
Bicyclo[2.2.1]hept-2-ene-2,3-dicarboxylic acid
CAS Number:
16508-04-6
Molecular Formula:
C9H10O4
Molecular Weight:
182.1733
IUPAC Name:
bicyclo[2.2.1]hept-2-ene-2,3-dicarboxylic acid
InChI:
InChI=1S/C9H10O4/c10-8(11)6-4-1-2-5(3-4)7(6)9(12)13/h4-5H,1-3H2,(H,10,11)(H,12,13)
InChI Key:
DVWBKCSKPCZFDE-UHFFFAOYSA-N
SMILES:
OC(=O)C1=C(C2CC1CC2)C(=O)O
Properties
Complexity:
286
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
182.058g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
182.175g/mol
Monoisotopic Mass:
182.058g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
74.6A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
Literature
| Title | Journal |
|---|---|
| Assay principle for modulators of protein-protein interactions and its application to non-ATP-competitive ligands targeting protein kinase A. | Analytical chemistry 20061215 |
| 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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