calcium-38(2+);hydride;naphthalene

C10H10Ca — CID 175266851

IUPACcalcium-38(2+);hydride;naphthalene
SMILES[38Ca+2].[H-].[H-].c1ccc2ccccc2c1
InChIInChI=1S/C10H8.Ca.2H/c1-2-6-10-8-4-3-7-9(10)5-1;;;/h1-8H;;;/q;+2;2*-1/i;1-2;;
InChIKeySFNYDJSGJCAQIS-KBSNFJSHSA-N
MW168.17 g/mol
LogP2.68
Rot. Bonds

About calcium-38(2+);hydride;naphthalene

calcium-38(2+);hydride;naphthalene (PubChem CID 175266851) has the molecular formula C10H10Ca and a molecular weight of 168.17 g/mol. Its IUPAC name is calcium-38(2+);hydride;naphthalene.

Molecular Properties

Compound Namecalcium-38(2+);hydride;naphthalene
PubChem CID175266851
Molecular FormulaC10H10Ca
Molecular Weight168.17 g/mol
Exact Mass168.05
IUPAC Namecalcium-38(2+);hydride;naphthalene
SMILES[38Ca+2].[H-].[H-].c1ccc2ccccc2c1
InChIInChI=1S/C10H8.Ca.2H/c1-2-6-10-8-4-3-7-9(10)5-1;;;/h1-8H;;;/q;+2;2*-1/i;1-2;;
InChIKeySFNYDJSGJCAQIS-KBSNFJSHSA-N
XLogP2.68
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.17
LogP ≤ 52.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

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CID 174958007
CID 174958007
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CID 144512894
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CID 19768161
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Frequently Asked Questions

What is the IUPAC name of calcium-38(2+);hydride;naphthalene?
The IUPAC name of calcium-38(2+);hydride;naphthalene (CID 175266851) is calcium-38(2+);hydride;naphthalene.
What is the SMILES notation for calcium-38(2+);hydride;naphthalene?
The canonical SMILES for calcium-38(2+);hydride;naphthalene is [38Ca+2].[H-].[H-].c1ccc2ccccc2c1.
What is the InChIKey of calcium-38(2+);hydride;naphthalene?
The InChIKey is SFNYDJSGJCAQIS-KBSNFJSHSA-N. The full InChI is InChI=1S/C10H8.Ca.2H/c1-2-6-10-8-4-3-7-9(10)5-1;;;/h1-8H;;;/q;+2;2*-1/i;1-2;;.
What are the key properties of calcium-38(2+);hydride;naphthalene?
calcium-38(2+);hydride;naphthalene has a molecular weight of 168.17 g/mol, XLogP of 2.68, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for calcium-38(2+);hydride;naphthalene is sourced from PubChem (CID 175266851), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).