Chemical Property of (2Z)-2-[1-[2-cyclopropyl-1-(2-fluorophenyl)-2-oxoethyl]-4-sulfanylpiperidin-3-ylidene]acetic acid
Chemical Property:
- Vapor Pressure:0mmHg at 25°C
- Refractive Index:1.619
- Boiling Point:513.424 °C at 760 mmHg
- PKA:3.24±0.41(Predicted)
- Flash Point:264.31 °C
- PSA:96.41000
- Density:1.34 g/cm3
- LogP:2.79890
- Storage Temp.:-20°C Freezer, Under inert atmosphere
- Solubility.:Chloroform (Slightly), Methanol (Slightly)
- XLogP3:-0.3
- Hydrogen Bond Donor Count:2
- Hydrogen Bond Acceptor Count:6
- Rotatable Bond Count:5
- Exact Mass:349.11479284
- Heavy Atom Count:24
- Complexity:534
- Purity/Quality:
-
99%, *data from raw suppliers
transR-138727,(PrasugrelMetabolite)->90%(MixtureofDiastereomers) *data from reagent suppliers
Safty Information:
- Pictogram(s):
- Hazard Codes:
- MSDS Files:
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SDS file from LookChem
Useful:
- Canonical SMILES:C1CC1C(=O)C(C2=CC=CC=C2F)N3CCC(C(=CC(=O)O)C3)S
- Isomeric SMILES:C1CC1C(=O)C(C2=CC=CC=C2F)N3CCC(/C(=C\C(=O)O)/C3)S
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Uses
trans R-138727, (Prasugrel Metabolite) - >90%_x000D_(Mixture of Diastereomers) (cas# 239466-74-1) is a compound useful in organic synthesis.