methanol;molecular chlorine

CH4Cl2O — CID 86677090

IUPACmethanol;molecular chlorine
SMILESCO.ClCl
InChIInChI=1S/CH4O.Cl2/c2*1-2/h2H,1H3;
InChIKeyZYHUDZDVFVZECM-UHFFFAOYSA-N
MW102.95 g/mol
LogP0.99
Rot. Bonds

About methanol;molecular chlorine

methanol;molecular chlorine (PubChem CID 86677090) has the molecular formula CH4Cl2O and a molecular weight of 102.95 g/mol. Its IUPAC name is methanol;molecular chlorine.

Molecular Properties

Compound Namemethanol;molecular chlorine
PubChem CID86677090
Molecular FormulaCH4Cl2O
Molecular Weight102.95 g/mol
Exact Mass101.96
IUPAC Namemethanol;molecular chlorine
SMILESCO.ClCl
InChIInChI=1S/CH4O.Cl2/c2*1-2/h2H,1H3;
InChIKeyZYHUDZDVFVZECM-UHFFFAOYSA-N
XLogP0.99
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms4
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500102.95
LogP ≤ 50.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of methanol;molecular chlorine?
The IUPAC name of methanol;molecular chlorine (CID 86677090) is methanol;molecular chlorine.
What is the SMILES notation for methanol;molecular chlorine?
The canonical SMILES for methanol;molecular chlorine is CO.ClCl.
What is the InChIKey of methanol;molecular chlorine?
The InChIKey is ZYHUDZDVFVZECM-UHFFFAOYSA-N. The full InChI is InChI=1S/CH4O.Cl2/c2*1-2/h2H,1H3;.
What are the key properties of methanol;molecular chlorine?
methanol;molecular chlorine has a molecular weight of 102.95 g/mol, XLogP of 0.99, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for methanol;molecular chlorine is sourced from PubChem (CID 86677090), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).