4-Methyl-3-nitrobenzamide
Properties
- Molecular formula
- C8H8N2O3
- Molar mass
- 180.16 g/mol
- Exact mass
- 180.0535 Da
- Melting point
- 168–169 °C
- logP
- 1.79Crippen estimate
- Polar surface area
- 87.2 Ų
- H-bond donors / acceptors
- 2 / 3
- Rotatable bonds
- 2
Hazards
Warning
- H302 Harmful if swallowed100% of notifiers
- H315 Causes skin irritation100% of notifiers
- H319 Causes serious eye irritation100% of notifiers
- H335 May cause respiratory irritation100% of notifiers
Aggregated from 4 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
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, P501
Identifiers
CAS number
19013-11-7SMILES
Cc1ccc(C(=N)O)cc1[N+](=O)[O-]InChIKey
YEUGEQUFPMJGCD-UHFFFAOYSA-NInChI
InChI=1S/C8H8N2O3/c1-5-2-3-6(8(9)11)4-7(5)10(12)13/h2-4H,1H3,(H2,9,11)Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
2 names
- Benzamide, 4-methyl-3-nitro-
- p-Toluamide, 3-nitro-
Work with 4-Methyl-3-nitrobenzamide
Similar compounds
Iniparib160003-66-770 % similar
4-Chloro-3-nitrobenzamide16588-06-068 % similar
4-Methyl-3-nitrobenzoic acid96-98-068 % similar
4-Methoxy-3-nitrobenzamide10397-58-765 % similar
3'-Nitro-4'-methylacetophenone5333-27-761 % similar
4-Methyl-3-nitrobenzoyl chloride10397-30-560 % similar
Methyl 3-nitro-4-methylbenzoate7356-11-857 % similar
3-Methyl-4-nitrobenzoic acid3113-71-156 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds