calcium;hydride;methane;phenol

C7H12CaO — CID 174360189

IUPACcalcium;hydride;methane;phenol
SMILESC.Oc1ccccc1.[Ca+2].[H-].[H-]
InChIInChI=1S/C6H6O.CH4.Ca.2H/c7-6-4-2-1-3-5-6;;;;/h1-5,7H;1H4;;;/q;;+2;2*-1
InChIKeyFVBCWADSZBOSMQ-UHFFFAOYSA-N
MW152.25 g/mol
LogP1.87
Rot. Bonds

About calcium;hydride;methane;phenol

calcium;hydride;methane;phenol (PubChem CID 174360189) has the molecular formula C7H12CaO and a molecular weight of 152.25 g/mol. Its IUPAC name is calcium;hydride;methane;phenol.

Molecular Properties

Compound Namecalcium;hydride;methane;phenol
PubChem CID174360189
Molecular FormulaC7H12CaO
Molecular Weight152.25 g/mol
Exact Mass152.05
IUPAC Namecalcium;hydride;methane;phenol
SMILESC.Oc1ccccc1.[Ca+2].[H-].[H-]
InChIInChI=1S/C6H6O.CH4.Ca.2H/c7-6-4-2-1-3-5-6;;;;/h1-5,7H;1H4;;;/q;;+2;2*-1
InChIKeyFVBCWADSZBOSMQ-UHFFFAOYSA-N
XLogP1.87
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.25
LogP ≤ 51.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze calcium;hydride;methane;phenol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

molybdenum;phenol
CID 154246724
cesium;hydride;phenol
CID 173020520
CID 173389191
CID 173389191
phenol;phosphane
CID 159689182
CID 67496590
CID 67496590
argon;phenol
CID 159678450
phenol;tantalum
CID 19915613
neodymium;phenol
CID 154361260
phenol;titanium(2+)
CID 23042599
CID 159904044
CID 159904044
aluminum phenol
CID 19023057
CID 161001247
CID 161001247

Frequently Asked Questions

What is the IUPAC name of calcium;hydride;methane;phenol?
The IUPAC name of calcium;hydride;methane;phenol (CID 174360189) is calcium;hydride;methane;phenol.
What is the SMILES notation for calcium;hydride;methane;phenol?
The canonical SMILES for calcium;hydride;methane;phenol is C.Oc1ccccc1.[Ca+2].[H-].[H-].
What is the InChIKey of calcium;hydride;methane;phenol?
The InChIKey is FVBCWADSZBOSMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H6O.CH4.Ca.2H/c7-6-4-2-1-3-5-6;;;;/h1-5,7H;1H4;;;/q;;+2;2*-1.
What are the key properties of calcium;hydride;methane;phenol?
calcium;hydride;methane;phenol has a molecular weight of 152.25 g/mol, XLogP of 1.87, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for calcium;hydride;methane;phenol is sourced from PubChem (CID 174360189), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).