Mrv0541 09211104532D          

  4  3  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 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2375   -0.7145    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2375    0.7145    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  1  3  1  0  0  0  0
  1  4  1  0  0  0  0
M  END
> <DATABASE_NAME>
t3db

> <DATABASE_ID>
T3D0244

> <SMILES>
C=O

> <INCHI_IDENTIFIER>
InChI=1S/CH2O/c1-2/h1H2

> <INCHI_KEY>
InChIKey=WSFSSNUMVMOOMR-UHFFFAOYSA-N

> <JCHEM_ACCEPTOR_COUNT>
1

> <JCHEM_AVERAGE_POLARIZABILITY>
2.578047880261086

> <JCHEM_DONOR_COUNT>
0

> <JCHEM_EXACT_MASS>
30.010564686

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_FORMULA>
CH2O

> <JCHEM_IUPAC>
formaldehyde

> <JCHEM_LOGP>
-0.46697540866666665

> <JCHEM_MASS>
30.026

> <JCHEM_POLAR_SURFACE_AREA>
17.07

> <JCHEM_REFRACTIVITY>
6.3069999999999995

> <JCHEM_ROTATABLE_BOND_COUNT>
0

> <JCHEM_TRADITIONAL_IUPAC>
formaldehyde

$$$$