formamide chloride

CH3ClNO- — CID 19069839

IUPACformamide chloride
SMILESNC=O.[Cl-]
InChIInChI=1S/CH3NO.ClH/c2-1-3;/h1H,(H2,2,3);1H/p-1
InChIKeyGTCCMGFBIWUBLQ-UHFFFAOYSA-M
MW80.49 g/mol
LogP-3.89
Rot. Bonds

About formamide chloride

formamide chloride (PubChem CID 19069839) has the molecular formula CH3ClNO- and a molecular weight of 80.49 g/mol. Its IUPAC name is formamide chloride.

Molecular Properties

Compound Nameformamide chloride
PubChem CID19069839
Molecular FormulaCH3ClNO-
Molecular Weight80.49 g/mol
Exact Mass79.99
IUPAC Nameformamide chloride
SMILESNC=O.[Cl-]
InChIInChI=1S/CH3NO.ClH/c2-1-3;/h1H,(H2,2,3);1H/p-1
InChIKeyGTCCMGFBIWUBLQ-UHFFFAOYSA-M
XLogP-3.89
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms4
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50080.49
LogP ≤ 5-3.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of formamide chloride?
The IUPAC name of formamide chloride (CID 19069839) is formamide chloride.
What is the SMILES notation for formamide chloride?
The canonical SMILES for formamide chloride is NC=O.[Cl-].
What is the InChIKey of formamide chloride?
The InChIKey is GTCCMGFBIWUBLQ-UHFFFAOYSA-M. The full InChI is InChI=1S/CH3NO.ClH/c2-1-3;/h1H,(H2,2,3);1H/p-1.
What are the key properties of formamide chloride?
formamide chloride has a molecular weight of 80.49 g/mol, XLogP of -3.89, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for formamide chloride is sourced from PubChem (CID 19069839), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).