Mrv0541 05031418282D          

  2  1  0  0  0  0            999 V2000
    0.8250    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.0000    0.0000 I   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
M  END
> <DATABASE_ID>
CHEM003999

> <DATABASE_NAME>
chemdb

> <SMILES>
CI

> <INCHI_IDENTIFIER>
InChI=1S/CH3I/c1-2/h1H3

> <INCHI_KEY>
INQOMBQAUSQDDS-UHFFFAOYSA-N

> <FORMULA>
CH3I

> <MOLECULAR_WEIGHT>
141.939

> <EXACT_MASS>
141.927943516

> <JCHEM_ACCEPTOR_COUNT>
0

> <JCHEM_AVERAGE_POLARIZABILITY>
7.431846675210221

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
0

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
iodomethane

> <ALOGPS_LOGP>
1.20

> <JCHEM_LOGP>
1.5555657386666668

> <ALOGPS_LOGS>
-1.12

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
0

> <JCHEM_PHYSIOLOGICAL_CHARGE>
0

> <JCHEM_POLAR_SURFACE_AREA>
0

> <JCHEM_REFRACTIVITY>
19.4953

> <JCHEM_ROTATABLE_BOND_COUNT>
0

> <JCHEM_RULE_OF_FIVE>
1

> <ALOGPS_SOLUBILITY>
1.09e+01 g/l

> <JCHEM_TRADITIONAL_IUPAC>
methyl iodide

> <JCHEM_VEBER_RULE>
1

> <NAME>
Methyl iodide

> <CAS>
74-88-4

> <SYNONYMS>
iodomethane

$$$$