CID 174785352

C10H12AlMoO — CID 174785352

IUPAC—
SMILESC.C1=Cc2ccccc2OC1.[Al].[Mo]
InChIInChI=1S/C9H8O.CH4.Al.Mo/c1-2-6-9-8(4-1)5-3-7-10-9;;;/h1-6H,7H2;1H4;;
InChIKeyRKVXUTHTGPFRCL-UHFFFAOYSA-N
MW271.13 g/mol
LogP2.35
Rot. Bonds

About CID 174785352

CID 174785352 (PubChem CID 174785352) has the molecular formula C10H12AlMoO and a molecular weight of 271.13 g/mol.

Molecular Properties

Compound NameCID 174785352
PubChem CID174785352
Molecular FormulaC10H12AlMoO
Molecular Weight271.13 g/mol
Exact Mass272.98
IUPAC Name—
SMILESC.C1=Cc2ccccc2OC1.[Al].[Mo]
InChIInChI=1S/C9H8O.CH4.Al.Mo/c1-2-6-9-8(4-1)5-3-7-10-9;;;/h1-6H,7H2;1H4;;
InChIKeyRKVXUTHTGPFRCL-UHFFFAOYSA-N
XLogP2.35
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.13
LogP ≤ 52.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of CID 174785352?
The IUPAC name of CID 174785352 (CID 174785352) is not available.
What is the SMILES notation for CID 174785352?
The canonical SMILES for CID 174785352 is C.C1=Cc2ccccc2OC1.[Al].[Mo].
What is the InChIKey of CID 174785352?
The InChIKey is RKVXUTHTGPFRCL-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8O.CH4.Al.Mo/c1-2-6-9-8(4-1)5-3-7-10-9;;;/h1-6H,7H2;1H4;;.
What are the key properties of CID 174785352?
CID 174785352 has a molecular weight of 271.13 g/mol, XLogP of 2.35, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 174785352 is sourced from PubChem (CID 174785352), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).