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Monochloroacetaldehyde (2,4-dinitrophenyl)hydrazone

HCID 9604899
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Basic information

CAS
5135-80-8
Standard SMILES
O=[N+]([O-])c1ccc(N/N=C/CCl)c([N+](=O)[O-])c1
InChIKey
KCCZBPFTPLCZGI-ONNFQVAWSA-N
Molecular formula
C8H7ClN4O4
Average molar mass
258.62 g/mol
Monoisotopic mass
258.0155824

Names & identifiers

Preferred name
Monochloroacetaldehyde (2,4-dinitrophenyl)hydrazone
IUPAC
N-[(E)-2-chloroethylideneamino]-2,4-dinitroaniline
English name
Chloroacetaldehyde (2,4-dinitrophenyl)hydrazone
Molecular formula
C8H7ClN4O4
Molecular weight
258.62

Names & synonyms

Olin 1763OM1763WLN: WNR CNW DMNU2GSCHEMBL11602689NSC158952NSC-158952AS-93855Monochloroacetaldehyde (2,4-dinitrophenyl)hydrazoneOlin-1763N-(2-chloroethylideneamino)-2,4-dinitro-anilineChloroacetaldehyde (2,4-dinitrophenyl)hydrazone(2,4-dinitrophenyl)hydrazone of chloroacetaldehyde
Show more names
1-(2-Chloroethylidene)-2-(2,4-dinitrophenyl)hydrazineAcetaldehyde, 2-chloro-, 2-(2,4-dinitrophenyl)hydrazone

Database identifiers

CAS
5135-80-8
PubChem CID
9604899
Nikkaji
J55.325E

Properties

Computed structural properties

XLogP
1.4
Topological polar surface area
116 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
6
Rotatable bonds
3
Heavy atoms
17
Formal charge
0
Complexity
314

Physicochemical properties

CAS DataBase Reference
5135 · 5135-80-8
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
302 · H302-H315-H319-H335
Precautionary statements
280 · P280-P305+P351+P338

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

Safety data

Signal word
Warning
Symbol(GHS)
GHS07
Hazard statements
H302-H315-H319-H335
Precautionary statements
P280-P305+P351+P338

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