formonitrile;hydrochloride

CH2ClN — CID 71345994

IUPACformonitrile;hydrochloride
SMILESC#N.Cl
InChIInChI=1S/CHN.ClH/c1-2;/h1H;1H
InChIKeyVSXLDBOVSVRINA-UHFFFAOYSA-N
MW63.49 g/mol
LogP0.56
Rot. Bonds

About formonitrile;hydrochloride

formonitrile;hydrochloride (PubChem CID 71345994) has the molecular formula CH2ClN and a molecular weight of 63.49 g/mol. Its IUPAC name is formonitrile;hydrochloride.

Molecular Properties

Compound Nameformonitrile;hydrochloride
PubChem CID71345994
Molecular FormulaCH2ClN
Molecular Weight63.49 g/mol
Exact Mass62.99
IUPAC Nameformonitrile;hydrochloride
SMILESC#N.Cl
InChIInChI=1S/CHN.ClH/c1-2;/h1H;1H
InChIKeyVSXLDBOVSVRINA-UHFFFAOYSA-N
XLogP0.56
TPSA23.79 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms3
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50063.49
LogP ≤ 50.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

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formonitrile;tantalum
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CID 88810962

Frequently Asked Questions

What is the IUPAC name of formonitrile;hydrochloride?
The IUPAC name of formonitrile;hydrochloride (CID 71345994) is formonitrile;hydrochloride.
What is the SMILES notation for formonitrile;hydrochloride?
The canonical SMILES for formonitrile;hydrochloride is C#N.Cl.
What is the InChIKey of formonitrile;hydrochloride?
The InChIKey is VSXLDBOVSVRINA-UHFFFAOYSA-N. The full InChI is InChI=1S/CHN.ClH/c1-2;/h1H;1H.
What are the key properties of formonitrile;hydrochloride?
formonitrile;hydrochloride has a molecular weight of 63.49 g/mol, XLogP of 0.56, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for formonitrile;hydrochloride is sourced from PubChem (CID 71345994), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).