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22996-18-5

22996-18-5 Structure

22996-18-5 Structure
IdentificationMore
[Name]

4-CHLORO-2-NITROBENZYL ALCOHOL
[CAS]

22996-18-5
[Synonyms]

4-CHLORO-2-NITROBENZYL ALCOHOL
2-Nitro-4-chlorobenzenemethanol
[EINECS(EC#)]

245-374-8
[Molecular Formula]

C7H6ClNO3
[MDL Number]

MFCD00007217
[Molecular Weight]

187.58
[MOL File]

22996-18-5.mol
Chemical PropertiesBack Directory
[Appearance]

white to light yellow crystal powder
[Melting point ]

90-92 °C (lit.)
[Boiling point ]

306.1±27.0 °C(Predicted)
[density ]

1.476±0.06 g/cm3(Predicted)
[storage temp. ]

Sealed in dry,Room Temperature
[form ]

solid
[pka]

13.57±0.10(Predicted)
[color ]

Beige
[InChI]

1S/C7H6ClNO3/c8-6-2-1-5(4-10)7(3-6)9(11)12/h1-3,10H,4H2
[InChIKey]

OAHGNOHGHOTZQU-UHFFFAOYSA-N
[SMILES]

OCc1ccc(Cl)cc1[N+]([O-])=O
[CAS DataBase Reference]

22996-18-5(CAS DataBase Reference)
Safety DataBack Directory
[Hazard Codes ]

Xi
[Risk Statements ]

36/37/38
[Safety Statements ]

26
[WGK Germany ]

3
[HS Code ]

2906290090
[Storage Class]

11 - Combustible Solids
[Hazard Classifications]

Eye Irrit. 2
Skin Irrit. 2
STOT SE 3
Hazard InformationBack Directory
[Chemical Properties]

white to light yellow crystal powder
[Uses]

4-Chloro-2-nitrobenzyl alcohol undergoes oxidation in the presence of pyridinium chlorochromate in dichloromethane to yield 4-chloro-2-nitrobenzaldehyde.
Spectrum DetailBack Directory
[Spectrum Detail]

4-CHLORO-2-NITROBENZYL ALCOHOL(22996-18-5)MS
4-CHLORO-2-NITROBENZYL ALCOHOL(22996-18-5)1HNMR
4-CHLORO-2-NITROBENZYL ALCOHOL(22996-18-5)13CNMR
4-CHLORO-2-NITROBENZYL ALCOHOL(22996-18-5)IR1
4-CHLORO-2-NITROBENZYL ALCOHOL(22996-18-5)IR2
4-CHLORO-2-NITROBENZYL ALCOHOL(22996-18-5)Raman
Well-known Reagent Company Product InformationBack Directory
[Sigma Aldrich]

22996-18-5(sigmaaldrich)
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