(4-Carboxybutyl)triphenylphosphonium Bromide - CAS 17814-85-6
Catalog: |
BB013408 |
Product Name: |
(4-Carboxybutyl)triphenylphosphonium Bromide |
CAS: |
17814-85-6 |
Synonyms: |
4-carboxybutyl(triphenyl)phosphonium;bromide; 4-carboxybutyl(triphenyl)phosphanium;bromide |
IUPAC Name: | 4-carboxybutyl(triphenyl)phosphanium;bromide |
Description: | (4-Carboxybutyl)triphenylphosphonium Bromide (CAS# 17814-85-6) is a compound useful in organic synthesis. |
Molecular Weight: | 443.31 |
Molecular Formula: | C23H24BrO2P |
Canonical SMILES: | C1=CC=C(C=C1)[P+](CCCCC(=O)O)(C2=CC=CC=C2)C3=CC=CC=C3.[Br-] |
InChI: | InChI=1S/C23H23O2P.BrH/c24-23(25)18-10-11-19-26(20-12-4-1-5-13-20,21-14-6-2-7-15-21)22-16-8-3-9-17-22;/h1-9,12-17H,10-11,18-19H2;1H |
InChI Key: | MLOSJPZSZWUDSK-UHFFFAOYSA-N |
MDL: | MFCD00011906 |
LogP: | 1.23940 |
GHS Hazard Statement: | H302 (12.5%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
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PMID | Publication Date | Title | Journal |
28496342 | 20170101 | Sialylation facilitates self-assembly of 3D multicellular prostaspheres by using cyclo-RGDfK(TPP) peptide | OncoTargets and therapy |
27608845 | 20161004 | Sialylation transmogrifies human breast and pancreatic cancer cells into 3D multicellular tumor spheroids using cyclic RGD-peptide induced self-assembly | Oncotarget |
14580710 | 20031101 | Facile synthesis of (Z)-tetracos-5-enoic acid and racemic cis-4-(2-octadecylcyclopropane-1-yl)-butanoic acid | Chemistry and physics of lipids |
Complexity: | 372 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 2 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 442.06973 |
Formal Charge: | 0 |
Heavy Atom Count: | 27 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 442.06973 |
Rotatable Bond Count: | 8 |
Topological Polar Surface Area: | 37.3 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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