Mrv0541 02241205432D          

  2  1  0  0  0  0            999 V2000
    0.8250    0.0000    0.0000 Al  0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.0000    0.0000 Ti  0  0  0  0  0  0  0  0  0  0  0  0
  1  2  3  0  0  0  0
M  END
> <DATABASE_ID>
T3D1543

> <DATABASE_NAME>
t3db

> <SMILES>
[Al]#[Ti]

> <INCHI_IDENTIFIER>
InChI=1S/Al.Ti

> <INCHI_KEY>
KHEQKSIHRDRLMG-UHFFFAOYSA-N

> <FORMULA>
AlTi

> <MOLECULAR_WEIGHT>
74.849

> <EXACT_MASS>
74.929485494

> <JCHEM_ACCEPTOR_COUNT>
0

> <JCHEM_AVERAGE_POLARIZABILITY>
3.6540797805913607

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
0

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
titaniumylidynealumane

> <JCHEM_LOGP>
-0.2

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
0

> <JCHEM_PHYSIOLOGICAL_CHARGE>
0

> <JCHEM_POLAR_SURFACE_AREA>
0

> <JCHEM_REFRACTIVITY>
0

> <JCHEM_ROTATABLE_BOND_COUNT>
0

> <JCHEM_RULE_OF_FIVE>
1

> <JCHEM_TRADITIONAL_IUPAC>
titaniumylidynealumane

> <JCHEM_VEBER_RULE>
1

> <T3DB_ID>
T3D1543

> <NAME>
Titanium aluminide

> <CAS>
12003-96-2

> <SYNONYMS>
TiAl

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

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