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7428-64-0 | 2-chloroethyl 2-(2,4-dichlorophenoxy)ethyl ethyl phosphate
CAS No: 7428-64-0 Catalog No: AG005CI0 MDL No:
Product Description
Catalog Number:
AG005CI0
Chemical Name:
2-chloroethyl 2-(2,4-dichlorophenoxy)ethyl ethyl phosphate
CAS Number:
7428-64-0
Molecular Formula:
C12H16Cl3O5P
Molecular Weight:
377.5852
IUPAC Name:
2-chloroethyl 2-(2,4-dichlorophenoxy)ethyl ethyl phosphate
InChI:
InChI=1S/C12H16Cl3O5P/c1-2-18-21(16,19-6-5-13)20-8-7-17-12-4-3-10(14)9-11(12)15/h3-4,9H,2,5-8H2,1H3
InChI Key:
CBXNLAMXWMNSQV-UHFFFAOYSA-N
SMILES:
ClCCOP(=O)(OCC)OCCOc1ccc(cc1Cl)Cl
Properties
Complexity:
334
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
375.98g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
377.579g/mol
Monoisotopic Mass:
375.98g/mol
Rotatable Bond Count:
10
Topological Polar Surface Area:
54A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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