Mrv0541 02241205202D          

  3  2  0  0  0  0            999 V2000
    1.2375   -0.7145    0.0000 Al  0  0  0  0  0  3  0  0  0  0  0  0
    1.9520   -1.1270    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.6664   -0.7145    0.0000 Al  0  0  0  0  0  3  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
M  END
> <DATABASE_ID>
T3D1507

> <DATABASE_NAME>
t3db

> <SMILES>
[AlH2]O[AlH2]

> <INCHI_IDENTIFIER>
InChI=1S/2Al.O.4H

> <INCHI_KEY>
KUCFPPGSLHZXBU-UHFFFAOYSA-N

> <FORMULA>
Al2H4O

> <MOLECULAR_WEIGHT>
73.9942

> <EXACT_MASS>
73.989291632

> <JCHEM_ACCEPTOR_COUNT>
1

> <JCHEM_AVERAGE_POLARIZABILITY>
6.247135207349638

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
0

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
(alumanyloxy)alumane

> <JCHEM_LOGP>
1.8672

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
0

> <JCHEM_PHYSIOLOGICAL_CHARGE>
0

> <JCHEM_PKA_STRONGEST_BASIC>
-4.145117056437709

> <JCHEM_POLAR_SURFACE_AREA>
9.23

> <JCHEM_REFRACTIVITY>
4.5502

> <JCHEM_ROTATABLE_BOND_COUNT>
0

> <JCHEM_RULE_OF_FIVE>
1

> <JCHEM_TRADITIONAL_IUPAC>
(alumanyloxy)alumane

> <JCHEM_VEBER_RULE>
1

> <T3DB_ID>
T3D1507

> <NAME>
Aluminium(I) oxide

> <CAS>
12004-36-3

> <SYNONYMS>
Al2O; Aluminum oxide

> <TYPES>
Inorganic Compound; Aluminum Compound; Household Toxin; Industrial/Workplace Toxin; Synthetic Compound

$$$$