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4-(2,4-Dinitrophenylazo)phenol

HCID 81192
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Basic information

CAS
16081-15-5
Standard SMILES
O=[N+]([O-])c1ccc(N=Nc2ccc(O)cc2)c([N+](=O)[O-])c1
InChIKey
SQAYGJNMLDVSHZ-UHFFFAOYSA-N
Molecular formula
C12H8N4O5
Average molar mass
288.22 g/mol
Monoisotopic mass
288.04946937

Names & identifiers

Preferred name
4-(2,4-Dinitrophenylazo)phenol
IUPAC
4-[(2,4-dinitrophenyl)diazenyl]phenol
English name
1,4-BENZOQUINONE-DNPH (MONO)
Molecular formula
C12H8N4O5
Molecular weight
288.22

Names & synonyms

4-(2,4-Dinitrophenylazo)phenol6690-51-316081-15-54-[(2,4-dinitrophenyl)diazenyl]phenolPhenol,4-[2-(2,4-dinitrophenyl)diazenyl]-Quinone 2,4-dinitrophenylhydrazone4-CdpaNSC770541,4-Benzoquinone-mono-DNPH1,4-Benzoquinone, mono-dnphSCHEMBL8851799SCHEMBL20641172
Show more names
1,4-Benzoquinone-DNPH1,4-BENZOQUINONE-DNPH (MONO)1,4-Benzoquinone-2,4-dinitrophenylhydrazine (mono)2,5-Cyclohexadiene-1,4-dione, 1-[2-(2,4-dinitrophenyl)hydrazone]
DTXSID80936414HJKVTXLZRJZVAT-UHFFFAOYSA-N4-(2,4-dinitrophenylazo) phenolDTXSID201040390NSC-77054AKOS024342581benzoquinone 2,4-dinitrophenylhydrazonePhenol, 4-((2,4-dinitrophenyl)azo)-

Database identifiers

CAS
16081-15-5、6690-51-3
PubChem CID
81192
DTXSID
DTXSID201040390
EC Number
803-316-4
Nikkaji
J713.378B

Properties

Computed structural properties

XLogP
3
Topological polar surface area
137 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
7
Rotatable bonds
2
Heavy atoms
21
Formal charge
0
Complexity
411

Physicochemical properties

Melting point
230 °C · 230 °C
Boiling point
463.2 · 463.2±55.0 °C(Predicted)
Density
1.54 · 1.54±0.1 g/cm3(Predicted)
storage temp.
2 · 2-8°C
pka
10.43 · 10.43±0.20(Predicted)
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
319 · H319-H335-H315
Precautionary statements
264 · P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
Hazard Codes
Xi
Risk Statements
36 · 36/37/38
Safety Statements
26 · 26

Safety & regulation

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

GHS classification

GHS Classification · 4 items

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]

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

Aggregated GHS information provided per 38 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard information

Hazard Classes and CategoriesSkin Irrit. 2 (100%)

Safety data

risk_code
36/37/38
Signal word
Warning
Symbol(GHS)
GHS07
hazard_code
Xi
safety_code
26
Hazard statements
H319-H335-H315
Precautionary statements
P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P

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