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141780-85-0 | Propanoic acid, 3-[(dibutoxyphosphinothioyl)thio]-, butyl ester
CAS No: 141780-85-0 Catalog No: AG001H70 MDL No:
Product Description
Catalog Number:
AG001H70
Chemical Name:
Propanoic acid, 3-[(dibutoxyphosphinothioyl)thio]-, butyl ester
CAS Number:
141780-85-0
Molecular Formula:
C15H31O4PS2
Molecular Weight:
370.5080
IUPAC Name:
butyl 3-dibutoxyphosphinothioylsulfanylpropanoate
InChI:
InChI=1S/C15H31O4PS2/c1-4-7-11-17-15(16)10-14-22-20(21,18-12-8-5-2)19-13-9-6-3/h4-14H2,1-3H3
InChI Key:
WOPBPCXLNIKDPO-UHFFFAOYSA-N
SMILES:
CCCCOC(=O)CCSP(=S)(OCCCC)OCCCC
Properties
Complexity:
313
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
370.14g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
370.503g/mol
Monoisotopic Mass:
370.14g/mol
Rotatable Bond Count:
16
Topological Polar Surface Area:
102A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.2
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