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Key Documents

137898

Sigma-Aldrich

5-Nitropseudocumene

99%

Synonym(s):

1,2,4-Trimethyl-5-nitrobenzene

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About This Item

Linear Formula:
(CH3)3C6H2NO2
CAS Number:
Molecular Weight:
165.19
EC Number:
MDL number:
UNSPSC Code:
12352100
PubChem Substance ID:

assay

99%

form

solid

bp

265 °C (lit.)

mp

68-72 °C (lit.)

SMILES string

Cc1cc(C)c(cc1C)[N+]([O-])=O

InChI

1S/C9H11NO2/c1-6-4-8(3)9(10(11)12)5-7(6)2/h4-5H,1-3H3

InChI key

WILMQVBUVCETSB-UHFFFAOYSA-N

pictograms

Exclamation mark

signalword

Warning

Hazard Classifications

Acute Tox. 4 Dermal - Acute Tox. 4 Inhalation - Acute Tox. 4 Oral - Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3

target_organs

Respiratory system

Storage Class

11 - Combustible Solids

wgk_germany

WGK 3

flash_point_f

Not applicable

flash_point_c

Not applicable

ppe

dust mask type N95 (US), Eyeshields, Gloves


Certificates of Analysis (COA)

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