(ALLYLOXYCARBONYL)METHYLTRIPHENYLPHOSPHONIUM CHLORIDE - CAS 100687-15-8
Catalog: |
BB043334 |
Product Name: |
(ALLYLOXYCARBONYL)METHYLTRIPHENYLPHOSPHONIUM CHLORIDE |
CAS: |
100687-15-8 |
Synonyms: |
(ALLYLOXYCARBONYL)METHYLTRIPHENYLPHOSPHONIUM CHLORIDE; (Allyloxycarbonyl)methyltriphenylphosphonium chloride, 97 % |
IUPAC Name: | (2-oxo-2-prop-2-enoxyethyl)-triphenylphosphanium;chloride |
Description: | (ALLYLOXYCARBONYL)METHYLTRIPHENYLPHOSPHONIUM CHLORIDE (CAS# 100687-15-8 ) is a useful research chemical. |
Molecular Weight: | 396.85 |
Molecular Formula: | C23H22ClO2P |
Canonical SMILES: | C=CCOC(=O)C[P+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3.[Cl-] |
InChI: | InChI=1S/C23H22O2P.ClH/c1-2-18-25-23(24)19-26(20-12-6-3-7-13-20,21-14-8-4-9-15-21)22-16-10-5-11-17-22;/h2-17H,1,18-19H2;1H/q+1;/p-1 |
InChI Key: | WHJJJHBEYSCBFB-UHFFFAOYSA-M |
Purity: | 97 % |
Complexity: | 398 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 2 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 396.1045946 |
Formal Charge: | 0 |
Heavy Atom Count: | 27 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 396.1045946 |
Rotatable Bond Count: | 8 |
Topological Polar Surface Area: | 26.3 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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