alumane;titanium;nitrate;hydrochloride

H4AlClNO3Ti- — CID 173363171

IUPACalumane;titanium;nitrate;hydrochloride
SMILESCl.O=[N+]([O-])[O-].[AlH3].[Ti]
InChIInChI=1S/Al.ClH.NO3.Ti.3H/c;;2-1(3)4;;;;/h;1H;;;;;/q;;-1;;;;
InChIKeySLMQMOYVOZUZHS-UHFFFAOYSA-N
MW176.34 g/mol
LogP-1.00
Rot. Bonds

About alumane;titanium;nitrate;hydrochloride

alumane;titanium;nitrate;hydrochloride (PubChem CID 173363171) has the molecular formula H4AlClNO3Ti- and a molecular weight of 176.34 g/mol. Its IUPAC name is alumane;titanium;nitrate;hydrochloride.

Molecular Properties

Compound Namealumane;titanium;nitrate;hydrochloride
PubChem CID173363171
Molecular FormulaH4AlClNO3Ti-
Molecular Weight176.34 g/mol
Exact Mass175.92
IUPAC Namealumane;titanium;nitrate;hydrochloride
SMILESCl.O=[N+]([O-])[O-].[AlH3].[Ti]
InChIInChI=1S/Al.ClH.NO3.Ti.3H/c;;2-1(3)4;;;;/h;1H;;;;;/q;;-1;;;;
InChIKeySLMQMOYVOZUZHS-UHFFFAOYSA-N
XLogP-1.00
TPSA66.20 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.34
LogP ≤ 5-1.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'nitro_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

neodymium(3+);samarium(3+);hexanitrate;hydrochloride
CID 174987261
osmium(4+) dinitrate
CID 54675422
tris(platinum(2+));hexanitrate
CID 158036528
europium(3+) trinitrate
CID 24983
technetium(7+) heptanitrate
CID 23031034
niobium(3+) trinitrate
CID 14693735
ruthenium(3+) nitrate
CID 21124620
platinum pentanitrate
CID 173027999
tetrakis(lanthanum(3+));trinitrate
CID 19804472
aluminum trinitrate
CID 26053
gold dinitrate
CID 161234525
samarium trinitrate
CID 21321193

Frequently Asked Questions

What is the IUPAC name of alumane;titanium;nitrate;hydrochloride?
The IUPAC name of alumane;titanium;nitrate;hydrochloride (CID 173363171) is alumane;titanium;nitrate;hydrochloride.
What is the SMILES notation for alumane;titanium;nitrate;hydrochloride?
The canonical SMILES for alumane;titanium;nitrate;hydrochloride is Cl.O=[N+]([O-])[O-].[AlH3].[Ti].
What is the InChIKey of alumane;titanium;nitrate;hydrochloride?
The InChIKey is SLMQMOYVOZUZHS-UHFFFAOYSA-N. The full InChI is InChI=1S/Al.ClH.NO3.Ti.3H/c;;2-1(3)4;;;;/h;1H;;;;;/q;;-1;;;;.
What are the key properties of alumane;titanium;nitrate;hydrochloride?
alumane;titanium;nitrate;hydrochloride has a molecular weight of 176.34 g/mol, XLogP of -1.00, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for alumane;titanium;nitrate;hydrochloride is sourced from PubChem (CID 173363171), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).