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25131-74-2 | Phosphonic acid, P-(2-chloroethyl)-, bis(1-methylethyl) ester
CAS No: 25131-74-2 Catalog No: AG002QLE MDL No:MFCD03411199
Product Description
Catalog Number:
AG002QLE
Chemical Name:
Phosphonic acid, P-(2-chloroethyl)-, bis(1-methylethyl) ester
CAS Number:
25131-74-2
Molecular Formula:
C8H18ClO3P
Molecular Weight:
228.6535
MDL Number:
MFCD03411199
IUPAC Name:
2-[2-chloroethyl(propan-2-yloxy)phosphoryl]oxypropane
InChI:
InChI=1S/C8H18ClO3P/c1-7(2)11-13(10,6-5-9)12-8(3)4/h7-8H,5-6H2,1-4H3
InChI Key:
UCSODMVCOIWLQR-UHFFFAOYSA-N
SMILES:
ClCCP(=O)(OC(C)C)OC(C)C
Properties
Complexity:
168
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
228.068g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
228.653g/mol
Monoisotopic Mass:
228.068g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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