disodium;dodecane;hydride;hydrochloride

C12H29ClNa2 — CID 175364607

IUPACdisodium;dodecane;hydride;hydrochloride
SMILESCCCCCCCCCCCC.Cl.[H-].[H-].[Na+].[Na+]
InChIInChI=1S/C12H26.ClH.2Na.2H/c1-3-5-7-9-11-12-10-8-6-4-2;;;;;/h3-12H2,1-2H3;1H;;;;/q;;2*+1;2*-1
InChIKeyHWSBNQDSGMPBRX-UHFFFAOYSA-N
MW254.80 g/mol
LogP-0.42
Rot. Bonds9

About disodium;dodecane;hydride;hydrochloride

disodium;dodecane;hydride;hydrochloride (PubChem CID 175364607) has the molecular formula C12H29ClNa2 and a molecular weight of 254.80 g/mol. Its IUPAC name is disodium;dodecane;hydride;hydrochloride.

Molecular Properties

Compound Namedisodium;dodecane;hydride;hydrochloride
PubChem CID175364607
Molecular FormulaC12H29ClNa2
Molecular Weight254.80 g/mol
Exact Mass254.18
IUPAC Namedisodium;dodecane;hydride;hydrochloride
SMILESCCCCCCCCCCCC.Cl.[H-].[H-].[Na+].[Na+]
InChIInChI=1S/C12H26.ClH.2Na.2H/c1-3-5-7-9-11-12-10-8-6-4-2;;;;;/h3-12H2,1-2H3;1H;;;;/q;;2*+1;2*-1
InChIKeyHWSBNQDSGMPBRX-UHFFFAOYSA-N
XLogP-0.42
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds9
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.80
LogP ≤ 5-0.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

sodium;hydride;tridecane
CID 172995973
sodium;octakis(decane);hydride
CID 173398930
magnesium;sodium;hydride;tetradecane
CID 173272965
icosane;tetrahydrochloride
CID 143212018
bis(heptane);hydrochloride
CID 160833718
pentacosane;hydrochloride
CID 172714496
nonadecane;hydrochloride
CID 172821128
calcium;hydride;octane
CID 173403164
methane;octane;dihydrochloride
CID 174397937
lithium;dodecane;hydride
CID 173115706
heptane;phosphane;trihydrochloride
CID 175501735
trilithium;hydride;icosane
CID 173415382

Frequently Asked Questions

What is the IUPAC name of disodium;dodecane;hydride;hydrochloride?
The IUPAC name of disodium;dodecane;hydride;hydrochloride (CID 175364607) is disodium;dodecane;hydride;hydrochloride.
What is the SMILES notation for disodium;dodecane;hydride;hydrochloride?
The canonical SMILES for disodium;dodecane;hydride;hydrochloride is CCCCCCCCCCCC.Cl.[H-].[H-].[Na+].[Na+].
What is the InChIKey of disodium;dodecane;hydride;hydrochloride?
The InChIKey is HWSBNQDSGMPBRX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26.ClH.2Na.2H/c1-3-5-7-9-11-12-10-8-6-4-2;;;;;/h3-12H2,1-2H3;1H;;;;/q;;2*+1;2*-1.
What are the key properties of disodium;dodecane;hydride;hydrochloride?
disodium;dodecane;hydride;hydrochloride has a molecular weight of 254.80 g/mol, XLogP of -0.42, 9 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for disodium;dodecane;hydride;hydrochloride is sourced from PubChem (CID 175364607), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).