sodium;1-ethylnaphthalene;hydride

C12H13Na — CID 174300793

IUPACsodium;1-ethylnaphthalene;hydride
SMILESCCc1cccc2ccccc12.[H-].[Na+]
InChIInChI=1S/C12H12.Na.H/c1-2-10-7-5-8-11-6-3-4-9-12(10)11;;/h3-9H,2H2,1H3;;/q;+1;-1
InChIKeyISHIQIQRBHDULM-UHFFFAOYSA-N
MW180.23 g/mol
LogP0.52
Rot. Bonds1

About sodium;1-ethylnaphthalene;hydride

sodium;1-ethylnaphthalene;hydride (PubChem CID 174300793) has the molecular formula C12H13Na and a molecular weight of 180.23 g/mol. Its IUPAC name is sodium;1-ethylnaphthalene;hydride.

Molecular Properties

Compound Namesodium;1-ethylnaphthalene;hydride
PubChem CID174300793
Molecular FormulaC12H13Na
Molecular Weight180.23 g/mol
Exact Mass180.09
IUPAC Namesodium;1-ethylnaphthalene;hydride
SMILESCCc1cccc2ccccc12.[H-].[Na+]
InChIInChI=1S/C12H12.Na.H/c1-2-10-7-5-8-11-6-3-4-9-12(10)11;;/h3-9H,2H2,1H3;;/q;+1;-1
InChIKeyISHIQIQRBHDULM-UHFFFAOYSA-N
XLogP0.52
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.23
LogP ≤ 50.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze sodium;1-ethylnaphthalene;hydride 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

azane;1-ethylnaphthalene
CID 19048185
1-ethylnaphthalene;pyrene
CID 174849884
sodium;1-ethylnaphthalene;phenoxide
CID 159168482
1-ethylnaphthalene;methylcyclopropane
CID 142069670
1,2-dimethylnaphthalene;1-ethylnaphthalene
CID 158986916
1-ethylnaphthalene;1-phenylnaphthalene
CID 173023243
1-ethylnaphthalene;N-prop-1-en-2-ylprop-1-en-2-amine
CID 142138952
1-ethylnaphthalene;prop-2-ene-1-sulfonyl chloride
CID 174651228
4-ethylanthracen-9-amine
CID 23131445
1-naphthalen-1-ylbutan-2-one
CID 4564544
1-(2,2-dimethylpropyl)naphthalene;methane
CID 145304916
2-ethyl-1-(2-ethylnaphthalen-1-yl)oxynaphthalene
CID 23191166

Frequently Asked Questions

What is the IUPAC name of sodium;1-ethylnaphthalene;hydride?
The IUPAC name of sodium;1-ethylnaphthalene;hydride (CID 174300793) is sodium;1-ethylnaphthalene;hydride.
What is the SMILES notation for sodium;1-ethylnaphthalene;hydride?
The canonical SMILES for sodium;1-ethylnaphthalene;hydride is CCc1cccc2ccccc12.[H-].[Na+].
What is the InChIKey of sodium;1-ethylnaphthalene;hydride?
The InChIKey is ISHIQIQRBHDULM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12.Na.H/c1-2-10-7-5-8-11-6-3-4-9-12(10)11;;/h3-9H,2H2,1H3;;/q;+1;-1.
What are the key properties of sodium;1-ethylnaphthalene;hydride?
sodium;1-ethylnaphthalene;hydride has a molecular weight of 180.23 g/mol, XLogP of 0.52, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for sodium;1-ethylnaphthalene;hydride is sourced from PubChem (CID 174300793), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).