benzene;dihydrochloride

C6H8Cl2 — CID 18003865

IUPACbenzene;dihydrochloride
SMILESCl.Cl.c1ccccc1
InChIInChI=1S/C6H6.2ClH/c1-2-4-6-5-3-1;;/h1-6H;2*1H
InChIKeyXILYOLONIFWGMT-UHFFFAOYSA-N
MW151.04 g/mol
LogP2.53
Rot. Bonds

About benzene;dihydrochloride

benzene;dihydrochloride (PubChem CID 18003865) has the molecular formula C6H8Cl2 and a molecular weight of 151.04 g/mol. Its IUPAC name is benzene;dihydrochloride.

Molecular Properties

Compound Namebenzene;dihydrochloride
PubChem CID18003865
Molecular FormulaC6H8Cl2
Molecular Weight151.04 g/mol
Exact Mass150.00
IUPAC Namebenzene;dihydrochloride
SMILESCl.Cl.c1ccccc1
InChIInChI=1S/C6H6.2ClH/c1-2-4-6-5-3-1;;/h1-6H;2*1H
InChIKeyXILYOLONIFWGMT-UHFFFAOYSA-N
XLogP2.53
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.04
LogP ≤ 52.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of benzene;dihydrochloride?
The IUPAC name of benzene;dihydrochloride (CID 18003865) is benzene;dihydrochloride.
What is the SMILES notation for benzene;dihydrochloride?
The canonical SMILES for benzene;dihydrochloride is Cl.Cl.c1ccccc1.
What is the InChIKey of benzene;dihydrochloride?
The InChIKey is XILYOLONIFWGMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H6.2ClH/c1-2-4-6-5-3-1;;/h1-6H;2*1H.
What are the key properties of benzene;dihydrochloride?
benzene;dihydrochloride has a molecular weight of 151.04 g/mol, XLogP of 2.53, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for benzene;dihydrochloride is sourced from PubChem (CID 18003865), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).