cyclohexane;molecular hydrogen

C6H20 — CID 167667425

IUPACcyclohexane;molecular hydrogen
SMILESC1CCCCC1.[H][H].[H][H].[H][H].[H][H]
InChIInChI=1S/C6H12.4H2/c1-2-4-6-5-3-1;;;;/h1-6H2;4*1H
InChIKeySVNSNDOVWFUEQS-UHFFFAOYSA-N
MW92.23 g/mol
LogP3.32
Rot. Bonds

About cyclohexane;molecular hydrogen

cyclohexane;molecular hydrogen (PubChem CID 167667425) has the molecular formula C6H20 and a molecular weight of 92.23 g/mol. Its IUPAC name is cyclohexane;molecular hydrogen.

Molecular Properties

Compound Namecyclohexane;molecular hydrogen
PubChem CID167667425
Molecular FormulaC6H20
Molecular Weight92.23 g/mol
Exact Mass92.16
IUPAC Namecyclohexane;molecular hydrogen
SMILESC1CCCCC1.[H][H].[H][H].[H][H].[H][H]
InChIInChI=1S/C6H12.4H2/c1-2-4-6-5-3-1;;;;/h1-6H2;4*1H
InChIKeySVNSNDOVWFUEQS-UHFFFAOYSA-N
XLogP3.32
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50092.23
LogP ≤ 53.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

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cyclobutane;cycloheptane;cyclohexane;cyclooctane;cyclopentane
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cycloheptane;cyclopropane
CID 165090184
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CID 158344196
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CID 23347282
CID 157153307
CID 157153307
cyclopentane;phosphane
CID 70501903
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CID 158205110

Frequently Asked Questions

What is the IUPAC name of cyclohexane;molecular hydrogen?
The IUPAC name of cyclohexane;molecular hydrogen (CID 167667425) is cyclohexane;molecular hydrogen.
What is the SMILES notation for cyclohexane;molecular hydrogen?
The canonical SMILES for cyclohexane;molecular hydrogen is C1CCCCC1.[H][H].[H][H].[H][H].[H][H].
What is the InChIKey of cyclohexane;molecular hydrogen?
The InChIKey is SVNSNDOVWFUEQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12.4H2/c1-2-4-6-5-3-1;;;;/h1-6H2;4*1H.
What are the key properties of cyclohexane;molecular hydrogen?
cyclohexane;molecular hydrogen has a molecular weight of 92.23 g/mol, XLogP of 3.32, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for cyclohexane;molecular hydrogen is sourced from PubChem (CID 167667425), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).