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18967-27-6 | 2-Propenoic acid, 2-methyl-, 2,4,6-trichlorophenyl ester
CAS No: 18967-27-6 Catalog No: AG002DUX MDL No:
Product Description
Catalog Number:
AG002DUX
Chemical Name:
2-Propenoic acid, 2-methyl-, 2,4,6-trichlorophenyl ester
CAS Number:
18967-27-6
Molecular Formula:
C10H7Cl3O2
Molecular Weight:
265.5204
IUPAC Name:
(2,4,6-trichlorophenyl) 2-methylprop-2-enoate
InChI:
InChI=1S/C10H7Cl3O2/c1-5(2)10(14)15-9-7(12)3-6(11)4-8(9)13/h3-4H,1H2,2H3
InChI Key:
DGZZQOZXBPFEIY-UHFFFAOYSA-N
SMILES:
O=C(C(=C)C)Oc1c(Cl)cc(cc1Cl)Cl
Properties
Complexity:
255
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
263.951g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
265.514g/mol
Monoisotopic Mass:
263.951g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.5
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