(5-Carboxypentyl)triphenylphosphonium Bromide - CAS 50889-29-7
Catalog: |
BB027245 |
Product Name: |
(5-Carboxypentyl)triphenylphosphonium Bromide |
CAS: |
50889-29-7 |
Synonyms: |
5-carboxypentyl(triphenyl)phosphonium;bromide; 5-carboxypentyl(triphenyl)phosphanium;bromide |
IUPAC Name: | 5-carboxypentyl(triphenyl)phosphanium;bromide |
Description: | (5-Carboxypentyl)triphenylphosphonium Bromide (CAS# 50889-29-7) is a compound useful in organic synthesis. |
Molecular Weight: | 457.34 |
Molecular Formula: | C24H26BrO2P |
Canonical SMILES: | C1=CC=C(C=C1)[P+](CCCCCC(=O)O)(C2=CC=CC=C2)C3=CC=CC=C3.[Br-] |
InChI: | InChI=1S/C24H25O2P.BrH/c25-24(26)19-11-4-12-20-27(21-13-5-1-6-14-21,22-15-7-2-8-16-22)23-17-9-3-10-18-23;/h1-3,5-10,13-18H,4,11-12,19-20H2;1H |
InChI Key: | JUWYRPZTZSWLCY-UHFFFAOYSA-N |
LogP: | 1.62950 |
GHS Hazard Statement: | H315 (95.56%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
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Complexity: | 386 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 2 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 456.08538 |
Formal Charge: | 0 |
Heavy Atom Count: | 28 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 456.08538 |
Rotatable Bond Count: | 9 |
Topological Polar Surface Area: | 37.3 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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