CAS 290366-59-5 2-Methyl-3-nitrobenzamide (HCID 3830592)

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Basic information

CAS: 290366-59-5
Standard SMILES: Cc1c(C(N)=O)cccc1[N+](=O)[O-]
InChIKey: RRDXGSJTLUNXHN-UHFFFAOYSA-N
Molecular formula: C8H8N2O3
Average molar mass: 180.16 g/mol

Names & identifiers

Preferred name: 2-Methyl-3-nitrobenzamide
IUPAC: 2-methyl-3-nitrobenzamide
English name: 2-Methyl-3-nitrobenzaMide
Molecular formula: C8H8N2O3
Molecular weight: 180.16

Names & synonyms

2-methyl-3-nitrobenzamide290366-59-5RefChem:475382845-097-82-methyl-3-nitro-benzamideOprea1_644626SCHEMBL1805928SCHEMBL1805930RRDXGSJTLUNXHN-UHFFFAOYSA-NQLA36659MFCD00463807STK395627

Show more names

Benzamide, 2-methyl-3-nitro-

AKOS003206800BS-27958DS-016452CS-0208390ST51015771EN300-61115G30840Z33546929

Database identifiers

CAS: 290366-59-5
PubChem CID: 3830592
EC Number: 845-097-8

Properties

Computed structural properties

XLogP: 1
Topological polar surface area: 88.9 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 3
Rotatable bonds: 1
Heavy atoms: 13
Formal charge: 0
Complexity: 224

Physicochemical properties

Boiling point: 277.2 · 277.2±28.0 °C(Predicted)
Density: 1.322 · 1.322±0.06 g/cm3(Predicted)
pka: 14.88 · 14.88±0.50(Predicted)
Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 312 · H312-H335-H319-H332-H315-H302
Precautionary statements: 264 · P264-P280-P305+P351+P338-P337+P313P-P280-P302+P352-P312-P322-P363-P501-P264-P280-P302+P352-P321-P332+P313-P362-P261-P271-P304+P340-P312-P264-P270-P301+P312-P330-P501

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, P317, 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

Signal word: Warning
Symbol(GHS): GHS07
Hazard statements: H312-H335-H319-H332-H315-H302
Precautionary statements: P264-P280-P305+P351+P338-P337+P313P-P280-P302+P352-P312-P322-P363-P501-P264-P280-P302+P352-P321-P332+P313-P362-P261-P271-P304+P340-P312-P264-P270-P301+P312-P330-P501