Free Chemical Databases
-
[Synonyms]
NSC202868
2524-16-5
[Structure]
[ Properties Computed from Structure]
Molecular Weight 158.586781 [g/mol] Molecular Formula C3H8ClOPS XLogP 2.6 H-Bond Donor 0 H-Bond Acceptor 1 Rotatable Bond Count 2 Exact Mass 157.9722 MonoIsotopic Mass 157.9722 Topological Polar Surface Area 9.2 Heavy Atom Count 7 Formal Charge 0 Complexity 94.9 Isotope Atom Count 0 Defined Atom StereoCenter Count 0 Undefined Atom StereoCenter Count 1 Defined Bond StereoCenter Count 0 Undefined Bond StereoCenter Count 0 Covalently-Bonded Unit Count 1
[ Descriptors Computed from Structure]
IUPAC Name: chloro-ethoxy-methyl-sulfanylidenephosphorane
Canonical SMILES: CCOP(=S)(C)Cl
InChI: InChI=1/C3H8ClOPS/c1-3-5-6(2,4)7/h3H2,1-2H3
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