Mrv1572004191601512D          

  9  8  0  0  0  0            999 V2000
    1.2375   -0.7145    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8250    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6500    0.0000    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8250    0.8250    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8250   -0.8250    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.8250    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000   -0.8250    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.8250    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.0000    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
  3  2  1  0  0  0  0
  4  2  1  0  0  0  0
  5  2  1  0  0  0  0
  8  1  1  0  0  0  0
  9  2  1  0  0  0  0
  9  6  2  0  0  0  0
  9  7  2  0  0  0  0
  9  8  1  0  0  0  0
M  END
> <DATABASE_ID>
CHEM006495

> <DATABASE_NAME>
chemdb

> <SMILES>
COS(=O)(=O)C(F)(F)F

> <INCHI_IDENTIFIER>
InChI=1S/C2H3F3O3S/c1-8-9(6,7)2(3,4)5/h1H3

> <INCHI_KEY>
OIRDBPQYVWXNSJ-UHFFFAOYSA-N

> <FORMULA>
C2H3F3O3S

> <MOLECULAR_WEIGHT>
164.1

> <EXACT_MASS>
163.97549962

> <JCHEM_ACCEPTOR_COUNT>
2

> <JCHEM_ATOM_COUNT>
12

> <JCHEM_AVERAGE_POLARIZABILITY>
9.727511762775352

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
0

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
methyl trifluoromethanesulfonate

> <ALOGPS_LOGP>
1.83

> <JCHEM_LOGP>
1.5259977786666665

> <ALOGPS_LOGS>
-1.75

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
0

> <JCHEM_PHYSIOLOGICAL_CHARGE>
0

> <JCHEM_POLAR_SURFACE_AREA>
43.370000000000005

> <JCHEM_REFRACTIVITY>
21.464199999999998

> <JCHEM_ROTATABLE_BOND_COUNT>
2

> <JCHEM_RULE_OF_FIVE>
1

> <ALOGPS_SOLUBILITY>
2.90e+00 g/l

> <JCHEM_TRADITIONAL_IUPAC>
triflate ester

> <JCHEM_VEBER_RULE>
0

> <NAME>
METHYL ACRYLATE-DVB(2%), COPOLYMER, AMINOLYZED WITH DMAPA

> <CAS>
977083-09-2

> <SYNONYMS>
.beta.-Cyclodextrin, methyl ethers; 1,3,5-Triazine-2,4-diamine, 6-ethoxy-N2-methyl-; 2-Propenoic acid, 2-methyl-, methyl ester, polymer with butyl 2-propenoate, ethyl 2-propenoate, zinc 2-methyl-2-propenoate (1:2) and zinc 2-propenoate (1:2), 2,2?-(1,2- diazenediyl)bis[2-methylbutanenitrile]- and 2,2?-(1,2-diazenediyl)bis[2- methylpropane; 2-Propenoic acid, 2-methyl-, methyl ester, polymer with ethyl 2-propenoate, 2,2,6,6-tetramethyl-4-piperidinyl ester; 2-Propenoic acid, 2-methyl-, polymer with butyl 2-propenoate and methyl 2-methyl-2-propenoate; 2-Propenoic acid, 2-methyl-, polymer with butyl 2-propenoate, (1-methylethenyl)benzene and methyl 2-methyl-2-propenoate; 2-Propenoic acid, 2-methyl-, polymer with butyl 2-propenoate, ethene, ethenylbenzene, ethyl 2-propenoate and methyl 2-methyl-2-propenoate; 2-Propenoic acid, 2-methyl-, polymer with butyl 2-propenoate, ethenylbenzene, ethyl 2-propenoate and methyl 2-methyl-2-propenoate; 2-Propenoic acid, 2-methyl-, polymer with ethenylbenzene, ethyl 2-propenoate, methyl 2-methyl-2-propenoate and 1,2-propanediol mono(2-methyl-2-propenoate); 3'H-Cyclopropa[1,9][5,6]fullerene-C60-Ih-3'-butanoic acid, 3'-phenyl-, methyl ester; 3'H-Cyclopropa[7,22][5,6]fullerene-C70-D5h(6)-3'-butanoic acid, 3'-phenyl-, methyl ester; 3'H-Cyclopropa[8,25][5,6]fullerene-C70-D5h(6)-3'-butanoic acid, 3'-phenyl-, methyl ester; Acetic acid, hydroxymethoxy-, methyl ester, reaction products with substituted alkylamine (generic); Amitraz metabolite [Methanimidamide, N-(2,4-dimethylphenyl)-N'-methyl-]; Bentazone methyl derivative; Benzenamine, 4-methyl-, reaction products with oleylamine and TDI; Benzenepropanoic acid, 3,5-bis(1,1-dimethylethyl)-4-hydroxy-, methyl ester, reaction products with 1,3-butanediol; Benzenepropanoic acid, 3,5-bis(1,1-dimethylethyl)-4-hydroxy-, methyl ester, reaction products with sodium hydrogen sulfate; Benzoic acid, 2,3,4,5-tetrachloro-6-cyano-, methyl ester, reaction products with 4-[(4-aminophenyl)azo]-3-methylbenzenamine and sodium methoxide; Borinic acid, B,B-diethyl-, methyl ester; Butyl acrylate, polymer with substituted methyl styrene, methyl methacrylate, and substituted silane; Carbamic acid, N-[1-methyl-1-[3-(1-m ethylethenyl)phenyl]ethyl]-, methyl ester; Ethanimidothioic acid, 2,2,2-trifluoro-N-[[(methylamino)carbonyl]oxy]-, methyl ester, (E)-; Methyl 2,2,3,3,4,4-hexafluoro-4-(trifluoroethenyloxy)butanoate; Methyl bis[(1,1,2,2-tetrahydroperfluoro (C8-C20)alkyl)thio]acetate; METHYL GLUCOSIDE-COCONUT OIL ESTER; Methyl N-methoxycarbothioylcarbamate; Methyl trifluoromethanesulfonate; MIXTURE OF METHYL CYCLOHEXADIENE AND METHYLENE CYCLOHEXENE; Octanoic acid, 2,2-bis (1-oxooctyl)oxy methyl -1,3-propanediyl ester; Poly(difluoromethylene), .alpha.-fluoro-.omega.-[2-[[2-(trimethylammonio)ethyl]thio]ethyl]-, methyl sulfate (1:1); Pyridine, methyl-, chloro derivs.; ROSIN, METHYL ESTER, PARTIALLY HYDROGENATED; STYRENE-DIVINYLBENZENE-METHYL ACRYLATE, SULFONATED TERPOLYMER; Zinc, bis[3-(acetyl-.kappa.O)-6-methyl-2H-pyran-2,4(3H)- dionato-.kappa.O4]diaqua-

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