(4-Methoxybenzyl)triphenylphosphonium chloride - CAS 3462-97-3
Catalog: |
BB043677 |
Product Name: |
(4-Methoxybenzyl)triphenylphosphonium chloride |
CAS: |
3462-97-3 |
Synonyms: |
Phosphonium, [(4-methoxyphenyl)methyl]triphenyl-, chloride (1:1); (p-Methoxybenzyl)triphenylphosphonium chloride; Phosphonium, (p-methoxybenzyl)triphenyl-, chloride; [(4-Methoxyphenyl)methyl]triphenylphosphonium chloride |
Related CAS: | 18583-41-0 (free base)
|
IUPAC Name: | (4-methoxyphenyl)methyl-triphenylphosphanium;chloride |
Description: | (4-Methoxybenzyl)triphenylphosphonium chloride is used to synthesize novel blood coagulation factor Xa inhibitors and various antiplatelet aggregation drugs. |
Molecular Weight: | 418.89 |
Molecular Formula: | C26H24ClOP |
Canonical SMILES: | COC1=CC=C(C=C1)C[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.[Cl-] |
InChI: | InChI=1S/C26H24OP.ClH/c1-27-23-19-17-22(18-20-23)21-28(24-11-5-2-6-12-24,25-13-7-3-8-14-25)26-15-9-4-10-16-26;/h2-20H,21H2,1H3;1H/q+1;/p-1 |
InChI Key: | YQXBNCFNXOFWLR-UHFFFAOYSA-M |
Melting Point: | 241-243°C |
Purity: | 98.0 % (NMR) |
Solubility: | Soluble in Water |
Appearance: | White Powder |
Storage: | Store at RT |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]; H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]; H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation] |
Precautionary Statement: | P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 |
Signal Word: | Warning |
Complexity: | 392 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 2 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 418.1253301 |
Formal Charge: | 0 |
Heavy Atom Count: | 29 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 418.1253301 |
Rotatable Bond Count: | 6 |
Topological Polar Surface Area: | 9.2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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