3-Nitro-2,6-xylidine

HCID 95945
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Basic information

CAS
67083-28-7
Standard SMILES
Cc1ccc([N+](=O)[O-])c(C)c1N
InChIKey
LDFJDBAOBVUXMQ-UHFFFAOYSA-N
Molecular formula
C8H10N2O2
Average molar mass
166.18 g/mol
Monoisotopic mass
166.07422756

Names & identifiers

Preferred name
3-Nitro-2,6-xylidine
IUPAC
2,6-dimethyl-3-nitroaniline
English name
3-nitro-2,6-xylidine
Molecular formula
C8H10N2O2
Molecular weight
166.18

Names & synonyms

3-Nitro-2,6-xylidineEINECS 266-566-8NSC 44282RefChem:504415266-566-82,6-dimethyl-3-nitroaniline67083-28-7MFCD001563482,6-DIMETHYL-3-NITROPHENYLAMINE2,6-dimethyl-3-nitro-aniline2,6-dimethyl-3-nitrobenzenamineNSC44282
Show more names
Benzenamine, 2,6-dimethyl-3-nitro-
Lidocaine Impurity 38Piribedil Impurity 322-amino-6-nitro-m-xylole3-Nitro-2,6-dimethylanilineSCHEMBL1265339SCHEMBL8300142SCHEMBL30711152DTXSID60986114

Database identifiers

CAS
67083-28-7
PubChem CID
95945
DTXSID
DTXSID60986114
EC Number
266-566-8
Nikkaji
J141.322H

Properties

Computed structural properties

XLogP
1.8
Topological polar surface area
71.8 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
0
Heavy atoms
12

Physicochemical properties

Melting point
81 · 81-82℃
Boiling point
328 · 328.0±37.0 °C(Predicted)
Density
1.22 · 1.220±0.06 g/cm3(Predicted)
storage temp.
2 · 2-8°C(protect from light)
form
solid
pka
2.19 · 2.19±0.10(Predicted)

Safety & regulation

GHS classification

GHS Classification · 4 items

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Hazard information

Hazard Classes and CategoriesAcute Tox. 4 (100%)

Safety data

hs_code
2921490090
Signal word
Warning
Symbol(GHS)
GHS07
Hazard statements
H302
Precautionary statements
P280-P305+P351+P338

Chemistry & industry

Upstream & downstream products

Suppliers45 total

上海康恩博医药科技有限公司17510465506 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
成都市久鼎化学技术有限公司18584079237 · [email protected]
温州共赢化学有限公司+86-0086-577-64498589 +86-15355981851 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]

Related reactions

3 records
New reaction record

Compound notes

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