Mrv0541 02241205072D          

  5  4  0  0  0  0            999 V2000
    0.8250   -0.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8250    0.0000    0.0000 Sn  0  0  0  0  0  0  0  0  0  0  0  0
    0.8250    0.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6500    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.0000    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  2  4  1  0  0  0  0
  2  5  1  0  0  0  0
M  END
> <DATABASE_ID>
T3D1240

> <DATABASE_NAME>
t3db

> <SMILES>
C[Sn](C)(C)Cl

> <INCHI_IDENTIFIER>
InChI=1S/3CH3.ClH.Sn/h3*1H3;1H;/q;;;;+1/p-1

> <INCHI_KEY>
KWTSZCJMWHGPOS-UHFFFAOYSA-M

> <FORMULA>
C3H9ClSn

> <MOLECULAR_WEIGHT>
199.27

> <EXACT_MASS>
199.941474566

> <JCHEM_ACCEPTOR_COUNT>
0

> <JCHEM_AVERAGE_POLARIZABILITY>
11.72807805092917

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
0

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
chlorotrimethylstannane

> <ALOGPS_LOGP>
1.44

> <JCHEM_LOGP>
1.0127999999999995

> <ALOGPS_LOGS>
-1.02

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
0

> <JCHEM_PHYSIOLOGICAL_CHARGE>
0

> <JCHEM_POLAR_SURFACE_AREA>
0

> <JCHEM_REFRACTIVITY>
23.476599999999998

> <JCHEM_ROTATABLE_BOND_COUNT>
0

> <JCHEM_RULE_OF_FIVE>
1

> <ALOGPS_SOLUBILITY>
1.89e+01 g/l

> <JCHEM_TRADITIONAL_IUPAC>
trimethyltin chloride

> <JCHEM_VEBER_RULE>
1

> <T3DB_ID>
T3D1240

> <NAME>
Trimethyltin chloride

> <CAS>
1066-45-1

> <SYNONYMS>
Chloro(trimethyl)stannane; Chlorotrimethylstannane; Chlorotrimethyltin; Rimethyltin monochloride; Stannylium, trimethyl-, chloride; Tin(+), trimethyl-, chloride; Tin(1+), trimethyl-, chloride; Trimethylchlorostannane; Trimethylchlorotin; Trimethylstannyl chloride; Trimethyltin monochloride

> <TYPES>
Organic Compound; Pesticide; Tin Compound; Organometallic; Pollutant; Industrial/Workplace Toxin; Synthetic Compound

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