calcium;hydride;oxolan-2-ylmethanol

C5H12CaO2 — CID 173198677

IUPACcalcium;hydride;oxolan-2-ylmethanol
SMILESOCC1CCCO1.[Ca+2].[H-].[H-]
InChIInChI=1S/C5H10O2.Ca.2H/c6-4-5-2-1-3-7-5;;;/h5-6H,1-4H2;;;/q;+2;2*-1
InChIKeyRCRVFMGSRMBNCH-UHFFFAOYSA-N
MW144.23 g/mol
LogP0.00
Rot. Bonds1

About calcium;hydride;oxolan-2-ylmethanol

calcium;hydride;oxolan-2-ylmethanol (PubChem CID 173198677) has the molecular formula C5H12CaO2 and a molecular weight of 144.23 g/mol. Its IUPAC name is calcium;hydride;oxolan-2-ylmethanol.

Molecular Properties

Compound Namecalcium;hydride;oxolan-2-ylmethanol
PubChem CID173198677
Molecular FormulaC5H12CaO2
Molecular Weight144.23 g/mol
Exact Mass144.05
IUPAC Namecalcium;hydride;oxolan-2-ylmethanol
SMILESOCC1CCCO1.[Ca+2].[H-].[H-]
InChIInChI=1S/C5H10O2.Ca.2H/c6-4-5-2-1-3-7-5;;;/h5-6H,1-4H2;;;/q;+2;2*-1
InChIKeyRCRVFMGSRMBNCH-UHFFFAOYSA-N
XLogP0.00
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.23
LogP ≤ 50.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

oxolan-2-ylmethanol;hydrochloride
CID 155166529
hydron;oxolan-2-ylmethanol
CID 174439667
methanol;[(2S)-oxolan-2-yl]methanol
CID 144618761
[(2S)-oxan-2-yl]methanol
CID 6950811
oxane;oxolan-2-ylmethanol
CID 70368060
carbonochloridic acid;oxolan-2-ylmethanol
CID 161118728
ethanol;oxan-2-ylmethanol
CID 66900182
ethane;[(2S)-oxan-2-yl]methanol;hydrate
CID 168916263
2-ethoxyoxolane;oxolan-2-ylmethanol
CID 160542333
methylcyclohexane;oxan-2-ylmethanol
CID 143263270
2-ethoxyethanol;oxolan-2-ylmethanol
CID 70426292
ethane;methanol;2-methyloxane;oxan-2-ylmethanol
CID 159746076

Frequently Asked Questions

What is the IUPAC name of calcium;hydride;oxolan-2-ylmethanol?
The IUPAC name of calcium;hydride;oxolan-2-ylmethanol (CID 173198677) is calcium;hydride;oxolan-2-ylmethanol.
What is the SMILES notation for calcium;hydride;oxolan-2-ylmethanol?
The canonical SMILES for calcium;hydride;oxolan-2-ylmethanol is OCC1CCCO1.[Ca+2].[H-].[H-].
What is the InChIKey of calcium;hydride;oxolan-2-ylmethanol?
The InChIKey is RCRVFMGSRMBNCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10O2.Ca.2H/c6-4-5-2-1-3-7-5;;;/h5-6H,1-4H2;;;/q;+2;2*-1.
What are the key properties of calcium;hydride;oxolan-2-ylmethanol?
calcium;hydride;oxolan-2-ylmethanol has a molecular weight of 144.23 g/mol, XLogP of 0.00, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for calcium;hydride;oxolan-2-ylmethanol is sourced from PubChem (CID 173198677), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).