ChemicalBook--->CAS DataBase List--->71176-55-1

71176-55-1

71176-55-1 Structure

71176-55-1 Structure
IdentificationBack Directory
[Name]

5-NITRO-M-XYLENE-ALPHA,ALPHA'-DIOL
[CAS]

71176-55-1
[Synonyms]

5-nitro-m-xylene-α,α'-diol
5-Nitro-M-xylene-α,α′-diol
5-Nitro-1,3-benzenedimethanol
1,3-BenzenediMethanol,5-nitro-
(5-Nitro-1,3-phenylene)diMethanol
5-NITRO-M-XYLENE-ALPHA,ALPHA'-DIOL
5-NITRO-1,3-DIHYDROXYMETHYLBENZENE
3-(Hydroxymethyl)-5-nitrobenzyl alcohol
3-(Hydroxymethyl)-5-nitro-phenylmethanol
[EINECS(EC#)]

275-255-6
[Molecular Formula]

C8H9NO4
[MDL Number]

MFCD00007274
[MOL File]

71176-55-1.mol
[Molecular Weight]

183.16
Chemical PropertiesBack Directory
[Melting point ]

94-96 °C (lit.)
[Boiling point ]

421.9±35.0 °C(Predicted)
[density ]

1.420
[storage temp. ]

Sealed in dry,Room Temperature
[form ]

solid
[pka]

13.45±0.10(Predicted)
[InChI]

InChI=1S/C8H9NO4/c10-4-6-1-7(5-11)3-8(2-6)9(12)13/h1-3,10-11H,4-5H2
[InChIKey]

FTLFITNFXXERLN-UHFFFAOYSA-N
[SMILES]

C1(CO)=CC([N+]([O-])=O)=CC(CO)=C1
Safety DataBack Directory
[WGK Germany ]

3
Hazard InformationBack Directory
[Uses]

5-Nitro-m-xylene-α,α′-diol was used to fabricate chemical sensor for detection of explosive 2,4,6-trinitrotoluene by planar integrated optical waveguide attenuated total reflection spectrometry.
Spectrum DetailBack Directory
[Spectrum Detail]

5-NITRO-M-XYLENE-ALPHA,ALPHA'-DIOL(71176-55-1)MS
5-NITRO-M-XYLENE-ALPHA,ALPHA'-DIOL(71176-55-1)1HNMR
5-NITRO-M-XYLENE-ALPHA,ALPHA'-DIOL(71176-55-1)13CNMR
5-NITRO-M-XYLENE-ALPHA,ALPHA'-DIOL(71176-55-1)IR1
5-NITRO-M-XYLENE-ALPHA,ALPHA'-DIOL(71176-55-1)IR2
5-NITRO-M-XYLENE-ALPHA,ALPHA'-DIOL(71176-55-1)Raman
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