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10075-13-5 | Phosphonic acid, (2-chloro-1,1,3,3-tetrafluoroallyl)-, dimethyl ester (8CI)
CAS No: 10075-13-5 Catalog No: AG0002SK MDL No:
Product Description
Catalog Number:
AG0002SK
Chemical Name:
Phosphonic acid, (2-chloro-1,1,3,3-tetrafluoroallyl)-, dimethyl ester (8CI)
CAS Number:
10075-13-5
Molecular Formula:
C5H6ClF4O3P
Molecular Weight:
256.5197
IUPAC Name:
2-chloro-3-dimethoxyphosphoryl-1,1,3,3-tetrafluoroprop-1-ene
InChI:
InChI=1S/C5H6ClF4O3P/c1-12-14(11,13-2)5(9,10)3(6)4(7)8/h1-2H3
InChI Key:
HNTMHLUPUHRLGE-UHFFFAOYSA-N
SMILES:
COP(=O)(C(C(=C(F)F)Cl)(F)F)OC
NSC Number:
98717
Properties
Complexity:
281
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
255.968g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
256.517g/mol
Monoisotopic Mass:
255.968g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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