(Isopropyloxycarbonylmethylene)triphenylphosphorane - CAS 110212-61-8
Catalog: |
BB043355 |
Product Name: |
(Isopropyloxycarbonylmethylene)triphenylphosphorane |
CAS: |
110212-61-8 |
Synonyms: |
SCHEMBL8598579; CTK0D4120; ZINC34514121; AKOS017343305; OR201491 |
IUPAC Name: | propan-2-yl 2-(triphenyl-λ5-phosphanylidene)acetate |
Description: | (Isopropyloxycarbonylmethylene)triphenylphosphorane (CAS# 110212-61-8 ) is a useful research chemical. |
Molecular Weight: | 362.41 |
Molecular Formula: | C23H23O2P |
Canonical SMILES: | CC(C)OC(=O)C=P(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3 |
InChI: | InChI=1S/C23H23O2P/c1-19(2)25-23(24)18-26(20-12-6-3-7-13-20,21-14-8-4-9-15-21)22-16-10-5-11-17-22/h3-19H,1-2H3 |
InChI Key: | KNQMHHOLXMJJGL-UHFFFAOYSA-N |
Purity: | 98 % |
Complexity: | 440 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 362.14356697 |
Formal Charge: | 0 |
Heavy Atom Count: | 26 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 362.14356697 |
Rotatable Bond Count: | 6 |
Topological Polar Surface Area: | 26.3 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 4.8 |
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