dichloromethane;N-ethylidenehydroxylamine

C3H7Cl2NO — CID 174600671

IUPACdichloromethane;N-ethylidenehydroxylamine
SMILESCC=NO.ClCCl
InChIInChI=1S/C2H5NO.CH2Cl2/c1-2-3-4;2-1-3/h2,4H,1H3;1H2
InChIKeyDJWSPYIHMSZKAV-UHFFFAOYSA-N
MW144.00 g/mol
LogP1.89
Rot. Bonds

About dichloromethane;N-ethylidenehydroxylamine

dichloromethane;N-ethylidenehydroxylamine (PubChem CID 174600671) has the molecular formula C3H7Cl2NO and a molecular weight of 144.00 g/mol. Its IUPAC name is dichloromethane;N-ethylidenehydroxylamine.

Molecular Properties

Compound Namedichloromethane;N-ethylidenehydroxylamine
PubChem CID174600671
Molecular FormulaC3H7Cl2NO
Molecular Weight144.00 g/mol
Exact Mass142.99
IUPAC Namedichloromethane;N-ethylidenehydroxylamine
SMILESCC=NO.ClCCl
InChIInChI=1S/C2H5NO.CH2Cl2/c1-2-3-4;2-1-3/h2,4H,1H3;1H2
InChIKeyDJWSPYIHMSZKAV-UHFFFAOYSA-N
XLogP1.89
TPSA32.59 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.00
LogP ≤ 51.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'alkyl_halide', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'oxime_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of dichloromethane;N-ethylidenehydroxylamine?
The IUPAC name of dichloromethane;N-ethylidenehydroxylamine (CID 174600671) is dichloromethane;N-ethylidenehydroxylamine.
What is the SMILES notation for dichloromethane;N-ethylidenehydroxylamine?
The canonical SMILES for dichloromethane;N-ethylidenehydroxylamine is CC=NO.ClCCl.
What is the InChIKey of dichloromethane;N-ethylidenehydroxylamine?
The InChIKey is DJWSPYIHMSZKAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H5NO.CH2Cl2/c1-2-3-4;2-1-3/h2,4H,1H3;1H2.
What are the key properties of dichloromethane;N-ethylidenehydroxylamine?
dichloromethane;N-ethylidenehydroxylamine has a molecular weight of 144.00 g/mol, XLogP of 1.89, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for dichloromethane;N-ethylidenehydroxylamine is sourced from PubChem (CID 174600671), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).