N-hydroxybenzenecarboximidoyl chloride

C7H6ClNO — CID 2756315

IUPACN-hydroxybenzenecarboximidoyl chloride
SMILESON=C(Cl)c1ccccc1
InChIInChI=1S/C7H6ClNO/c8-7(9-10)6-4-2-1-3-5-6/h1-5,10H
InChIKeyGYHKODORJRRYBU-UHFFFAOYSA-N
MW155.58 g/mol
LogP2.06
Rot. Bonds1

About N-hydroxybenzenecarboximidoyl chloride

N-hydroxybenzenecarboximidoyl chloride (PubChem CID 2756315) has the molecular formula C7H6ClNO and a molecular weight of 155.58 g/mol. Its IUPAC name is N-hydroxybenzenecarboximidoyl chloride.

Molecular Properties

Compound NameN-hydroxybenzenecarboximidoyl chloride
PubChem CID2756315
Molecular FormulaC7H6ClNO
Molecular Weight155.58 g/mol
Exact Mass155.01
IUPAC NameN-hydroxybenzenecarboximidoyl chloride
SMILESON=C(Cl)c1ccccc1
InChIInChI=1S/C7H6ClNO/c8-7(9-10)6-4-2-1-3-5-6/h1-5,10H
InChIKeyGYHKODORJRRYBU-UHFFFAOYSA-N
XLogP2.06
TPSA32.59 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.58
LogP ≤ 52.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'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 N-hydroxybenzenecarboximidoyl chloride?
The IUPAC name of N-hydroxybenzenecarboximidoyl chloride (CID 2756315) is N-hydroxybenzenecarboximidoyl chloride.
What is the SMILES notation for N-hydroxybenzenecarboximidoyl chloride?
The canonical SMILES for N-hydroxybenzenecarboximidoyl chloride is ON=C(Cl)c1ccccc1.
What is the InChIKey of N-hydroxybenzenecarboximidoyl chloride?
The InChIKey is GYHKODORJRRYBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6ClNO/c8-7(9-10)6-4-2-1-3-5-6/h1-5,10H.
What are the key properties of N-hydroxybenzenecarboximidoyl chloride?
N-hydroxybenzenecarboximidoyl chloride has a molecular weight of 155.58 g/mol, XLogP of 2.06, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-hydroxybenzenecarboximidoyl chloride is sourced from PubChem (CID 2756315), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).