sodium;hydride;octadec-2-ene

C18H37Na — CID 175594563

IUPACsodium;hydride;octadec-2-ene
SMILESCC=CCCCCCCCCCCCCCCC.[H-].[Na+]
InChIInChI=1S/C18H36.Na.H/c1-3-5-7-9-11-13-15-17-18-16-14-12-10-8-6-4-2;;/h3,5H,4,6-18H2,1-2H3;;/q;+1;-1
InChIKeyDMNLDUOBKUYPFP-UHFFFAOYSA-N
MW276.48 g/mol
LogP4.16
Rot. Bonds14

About sodium;hydride;octadec-2-ene

sodium;hydride;octadec-2-ene (PubChem CID 175594563) has the molecular formula C18H37Na and a molecular weight of 276.48 g/mol. Its IUPAC name is sodium;hydride;octadec-2-ene.

Molecular Properties

Compound Namesodium;hydride;octadec-2-ene
PubChem CID175594563
Molecular FormulaC18H37Na
Molecular Weight276.48 g/mol
Exact Mass276.28
IUPAC Namesodium;hydride;octadec-2-ene
SMILESCC=CCCCCCCCCCCCCCCC.[H-].[Na+]
InChIInChI=1S/C18H36.Na.H/c1-3-5-7-9-11-13-15-17-18-16-14-12-10-8-6-4-2;;/h3,5H,4,6-18H2,1-2H3;;/q;+1;-1
InChIKeyDMNLDUOBKUYPFP-UHFFFAOYSA-N
XLogP4.16
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds14
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.48
LogP ≤ 54.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

(Z)-icos-2-ene
CID 5352524
octadeca-2,10-diene
CID 54270716
(2E,8Z)-pentadeca-2,8-diene
CID 173032001
(Z)-oct-2-ene
CID 5356796
pentadeca-2,6-diene
CID 165019979
oct-2-ene;hydrochloride
CID 86744102
pentadeca-2,10-diene
CID 174048350
disodium;hydride;(Z)-octadec-9-ene
CID 173005527
(2Z,6E)-dodeca-2,6-diene;palladium
CID 158734810
(Z)-dodec-2-ene;propan-2-one
CID 175013676
15,19-diethyltetracos-2-ene
CID 173194589
magnesium;hydride;(Z)-octadec-9-ene
CID 173078644

Frequently Asked Questions

What is the IUPAC name of sodium;hydride;octadec-2-ene?
The IUPAC name of sodium;hydride;octadec-2-ene (CID 175594563) is sodium;hydride;octadec-2-ene.
What is the SMILES notation for sodium;hydride;octadec-2-ene?
The canonical SMILES for sodium;hydride;octadec-2-ene is CC=CCCCCCCCCCCCCCCC.[H-].[Na+].
What is the InChIKey of sodium;hydride;octadec-2-ene?
The InChIKey is DMNLDUOBKUYPFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H36.Na.H/c1-3-5-7-9-11-13-15-17-18-16-14-12-10-8-6-4-2;;/h3,5H,4,6-18H2,1-2H3;;/q;+1;-1.
What are the key properties of sodium;hydride;octadec-2-ene?
sodium;hydride;octadec-2-ene has a molecular weight of 276.48 g/mol, XLogP of 4.16, 14 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for sodium;hydride;octadec-2-ene is sourced from PubChem (CID 175594563), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).