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13674-92-5 | Phosphoric acid, dibutyl 2-chloroethyl ester
CAS No: 13674-92-5 Catalog No: AG0012AY MDL No:
Product Description
Catalog Number:
AG0012AY
Chemical Name:
Phosphoric acid, dibutyl 2-chloroethyl ester
CAS Number:
13674-92-5
Molecular Formula:
C10H22ClO4P
Molecular Weight:
272.7060
IUPAC Name:
dibutyl 2-chloroethyl phosphate
InChI:
InChI=1S/C10H22ClO4P/c1-3-5-8-13-16(12,15-10-7-11)14-9-6-4-2/h3-10H2,1-2H3
InChI Key:
LYYGKHQNRUVHKR-UHFFFAOYSA-N
SMILES:
CCCCOP(=O)(OCCCC)OCCCl
Properties
Complexity:
187
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
272.094g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
272.706g/mol
Monoisotopic Mass:
272.094g/mol
Rotatable Bond Count:
11
Topological Polar Surface Area:
44.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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