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192723-80-1 | Phosphonic acid, [[5-(chlorocarbonyl)-2-thienyl]methyl]-, diethyl ester (9CI)
CAS No: 192723-80-1 Catalog No: AG002G9R MDL No:
Product Description
Catalog Number:
AG002G9R
Chemical Name:
Phosphonic acid, [[5-(chlorocarbonyl)-2-thienyl]methyl]-, diethyl ester (9CI)
CAS Number:
192723-80-1
Molecular Formula:
C10H14ClO4PS
Molecular Weight:
296.7075
IUPAC Name:
5-(diethoxyphosphorylmethyl)thiophene-2-carbonyl chloride
InChI:
InChI=1S/C10H14ClO4PS/c1-3-14-16(13,15-4-2)7-8-5-6-9(17-8)10(11)12/h5-6H,3-4,7H2,1-2H3
InChI Key:
XLVCJVJMVNPADM-UHFFFAOYSA-N
SMILES:
CCOP(=O)(Cc1ccc(s1)C(=O)Cl)OCC
Properties
Complexity:
303
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
296.004g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
296.702g/mol
Monoisotopic Mass:
296.004g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
80.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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