CID 163366410

C6H8 — CID 163366410

IUPAC—
SMILES[2H][2H].[2H]c1ccccc1
InChIInChI=1S/C6H6.H2/c1-2-4-6-5-3-1;/h1-6H;1H/i1D;1+1D
InChIKeyMDEVOVJNQJIRMC-MPBUAPJNSA-N
MW83.15 g/mol
LogP1.93
Rot. Bonds

About CID 163366410

CID 163366410 (PubChem CID 163366410) has the molecular formula C6H8 and a molecular weight of 83.15 g/mol.

Molecular Properties

Compound NameCID 163366410
PubChem CID163366410
Molecular FormulaC6H8
Molecular Weight83.15 g/mol
Exact Mass83.08
IUPAC Name—
SMILES[2H][2H].[2H]c1ccccc1
InChIInChI=1S/C6H6.H2/c1-2-4-6-5-3-1;/h1-6H;1H/i1D;1+1D
InChIKeyMDEVOVJNQJIRMC-MPBUAPJNSA-N
XLogP1.93
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50083.15
LogP ≤ 51.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of CID 163366410?
The IUPAC name of CID 163366410 (CID 163366410) is not available.
What is the SMILES notation for CID 163366410?
The canonical SMILES for CID 163366410 is [2H][2H].[2H]c1ccccc1.
What is the InChIKey of CID 163366410?
The InChIKey is MDEVOVJNQJIRMC-MPBUAPJNSA-N. The full InChI is InChI=1S/C6H6.H2/c1-2-4-6-5-3-1;/h1-6H;1H/i1D;1+1D.
What are the key properties of CID 163366410?
CID 163366410 has a molecular weight of 83.15 g/mol, XLogP of 1.93, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 163366410 is sourced from PubChem (CID 163366410), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).