N-Hydroxybenzenecarboximidoyl chloride

C₇H₆ClNOCAS 698-16-8155.58 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₇H₆ClNO
Molar mass: 155.58 g/mol
Exact mass: 155.0138 Da
logP: 2.06Crippen estimate
Polar surface area: 32.6 Å²
H-bond donors / acceptors: 1 / 2
Rotatable bonds: 1
Double bonds: ZE/Z, in SMILES order

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number

698-16-8

SMILES

C1=CC=C(C=C1)/C(=N/O)/Cl

InChIKey

GYHKODORJRRYBU-CLFYSBASSA-N

InChI

InChI=1S/C7H6ClNO/c8-7(9-10)6-4-2-1-3-5-6/h1-5,10H/b9-7-

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

1 names

Alpha-chlorobenzaldoxime

Work with N-Hydroxybenzenecarboximidoyl chloride

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Diphenylglyoxime23873-81-656 % similar Diphenyl ketoxime574-66-356 % similar Benzohydroxamic acid495-18-152 % similar Acetophenonoxime613-91-250 % similar Benzyl phenyl ketoxime952-06-747 % similar Benzoyl chloride98-88-444 % similar 1-Phenyl-1,2-propanedione 2-oxime119-51-742 % similar (±)-Benzoin oxime441-38-342 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

2-Amino-5-chlorobenzaldehyde20028-53-9 1-(2-Chloro-pyridin-4-yl)-ethanone23794-15-2 2-Chlorobenzaldehyde oxime3717-28-0 3-Acetyl-2-chloropyridine55676-21-6 2-Chloro-5-acetylpyridine55676-22-7 2-Chlorobenzamide609-66-5 3-Chlorobenzamide618-48-4 4-Chlorobenzamide619-56-7

Elsewhere

PubChem CAS Common Chemistry NIST WebBook