N-[(2,3-dichlorophenyl)methylidene]hydroxylamine

HCID 718876
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Substructure searchFind similar structures

Basic information

CAS
4414-54-4
Standard SMILES
ON=Cc1cccc(Cl)c1Cl
InChIKey
UDEADLUKAYYZNF-UHFFFAOYSA-N
Molecular formula
C7H5Cl2NO
Average molar mass
190.02 g/mol
Monoisotopic mass
188.97481914

Names & identifiers

Preferred name
N-[(2,3-dichlorophenyl)methylidene]hydroxylamine
IUPAC
N-[(2,3-dichlorophenyl)methylidene]hydroxylamine
English name
2,3-Dichlorobenzaldoxime
Molecular formula
C7H5Cl2NO
Molecular weight
190.03

Names & synonyms

N-[(2,3-dichlorophenyl)methylidene]hydroxylamineN-((2,3-dichlorophenyl)methylidene)hydroxylamineRefChem:822835875-427-62,3-dichlorobenzaldehyde oxime2,3-Dichlor-benzaldoxim(NE)-N-[(2,3-dichlorophenyl)methylidene]hydroxylamineMaybridge1_008391SCHEMBL5340172,3 dichlorobenzaldehyde oximeSCHEMBL6081649SCHEMBL6081655
Show more names
2,3-DichlorobenzaldoximeBenzaldehyde, 2,3-dichloro-, oxime(Z)-2,3-dichlorobenzaldehyde oxime(E)-2,3-Dichlorobenzaldehyde oximeN-[(2,3-dichlorophenyl)methylidene]hydroxylamin e
SCHEMBL32680261DTXSID80352099UDEADLUKAYYZNF-UHFFFAOYSA-NDB-019710

Database identifiers

CAS
4414-54-4
PubChem CID
718876
DTXSID
DTXSID80352099
EC Number
875-427-6

Properties

Computed structural properties

XLogP
2.9
Topological polar surface area
32.6 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
1
Heavy atoms
11

Physicochemical properties

Melting point
127 · 127-129
Boiling point
287.5 · 287.5±30.0 °C(Predicted)
Density
1.38 · 1.38±0.1 g/cm3(Predicted)
form
crystalline powder
pka
10.2 · 10.20±0.10(Predicted)
color
Beige

Safety & regulation

GHS classification

GHS Classification · 4 items

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Hazard information

Hazard Classes and CategoriesAcute Tox. 4 (100%)

Safety data

hs_code
2928009090
Signal word
Warning
Symbol(GHS)
GHS07
hazard_code
Xi
hazard_note
Irritant
Hazard statements
H315-H319-H335

Chemistry & industry

Applications

Uses2,3-Dichlorobenzaldoxime is used in preparation of substituted heterocyclic compounds for the treatment of cardiovascular diseases.

Suppliers9 total

Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
HANGZHOU LEAP CHEM CO., LTD.+86-571-87711850 +86-15355479329 · [email protected]
大连金点生物科技有限公司0411-0411-00000000 13644282108 · [email protected]
江苏艾康生物医药研发有限公司025-58851090 13913916777 · [email protected]
ATK CHEMICAL COMPANY LIMITED+undefined-21-51877795 · [email protected]

Related reactions

2 records
New reaction record

Compound notes

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