CID 175796970

AlCoMoS2 — CID 175796970

IUPAC—
SMILESS=[Mo]=S.[Al].[Co]
InChIInChI=1S/Al.Co.Mo.2S
InChIKeyDACZSRJXTFEMRP-UHFFFAOYSA-N
MW245.99 g/mol
LogP0.91
Rot. Bonds

About CID 175796970

CID 175796970 (PubChem CID 175796970) has the molecular formula AlCoMoS2 and a molecular weight of 245.99 g/mol.

Molecular Properties

Compound NameCID 175796970
PubChem CID175796970
Molecular FormulaAlCoMoS2
Molecular Weight245.99 g/mol
Exact Mass247.76
IUPAC Name—
SMILESS=[Mo]=S.[Al].[Co]
InChIInChI=1S/Al.Co.Mo.2S
InChIKeyDACZSRJXTFEMRP-UHFFFAOYSA-N
XLogP0.91
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.99
LogP ≤ 50.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of CID 175796970?
The IUPAC name of CID 175796970 (CID 175796970) is not available.
What is the SMILES notation for CID 175796970?
The canonical SMILES for CID 175796970 is S=[Mo]=S.[Al].[Co].
What is the InChIKey of CID 175796970?
The InChIKey is DACZSRJXTFEMRP-UHFFFAOYSA-N. The full InChI is InChI=1S/Al.Co.Mo.2S.
What are the key properties of CID 175796970?
CID 175796970 has a molecular weight of 245.99 g/mol, XLogP of 0.91, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 175796970 is sourced from PubChem (CID 175796970), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).