4-(1,2,2-Triphenylvinyl)benzoic Acid - CAS 197153-87-0
Catalog: |
BB015230 |
Product Name: |
4-(1,2,2-Triphenylvinyl)benzoic Acid |
CAS: |
197153-87-0 |
Synonyms: |
4-(1,2,2-triphenylethenyl)benzoic acid; 4-(1,2,2-triphenylethenyl)benzoic acid |
IUPAC Name: | 4-(1,2,2-triphenylethenyl)benzoic acid |
Description: | 4-(1,2,2-Triphenylvinyl)benzoic Acid (CAS# 197153-87-0 ) is a useful research chemical. |
Molecular Weight: | 376.45 |
Molecular Formula: | C27H20O2 |
Canonical SMILES: | C1=CC=C(C=C1)C(=C(C2=CC=CC=C2)C3=CC=C(C=C3)C(=O)O)C4=CC=CC=C4 |
InChI: | InChI=1S/C27H20O2/c28-27(29)24-18-16-23(17-19-24)26(22-14-8-3-9-15-22)25(20-10-4-1-5-11-20)21-12-6-2-7-13-21/h1-19H,(H,28,29) |
InChI Key: | BYQULXPMSUDNFL-UHFFFAOYSA-N |
LogP: | 6.39220 |
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Complexity: | 531 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 376.146329876 |
Formal Charge: | 0 |
Heavy Atom Count: | 29 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 376.146329876 |
Rotatable Bond Count: | 5 |
Topological Polar Surface Area: | 37.3 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 7.5 |
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