3-Amino-5-methylisoxazole
Properties
- Molecular formula
- C4H6N2O
- Molar mass
- 98.11 g/mol
- Exact mass
- 98.0480 Da
- Melting point
- 61–62 °C
- logP
- 0.40Crippen estimate
- Polar surface area
- 52.8 Ų
- H-bond donors / acceptors
- 2 / 2
- Rotatable bonds
- 0
Hazards
Danger
- H228 Flammable solid12.5% of notifiers
- H315 Causes skin irritation75% of notifiers
- H319 Causes serious eye irritation75% of notifiers
- H335 May cause respiratory irritation62.5% of notifiers
- H341 Suspected of causing genetic defects12.5% of notifiers
- H351 Suspected of causing cancer12.5% of notifiers
Aggregated from 8 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P203, P210, P240, P241, P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P318, P319, P321, P332+P317, P337+P317, P362+P364, P370+P378, P403+P233, P405, P501
Identifiers
CAS number
1072-67-9SMILES
Cc1cc(=N)[nH]o1InChIKey
FKPXGNGUVSHWQQ-UHFFFAOYSA-NInChI
InChI=1S/C4H6N2O/c1-3-2-4(5)6-7-3/h2H,1H3,(H2,5,6)Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
7 names
- 3-Isoxazolamine, 5-methyl-
- Isoxazole, 3-amino-5-methyl-
- 5-Methyl-3-isoxazolamine
- 5-Methyl-3-aminoisoxazole
- 5-Methyl-3-isoxazolylamine
- 5-Methyl-1,2-oxazol-3-amine
- NSC 159134
Work with 3-Amino-5-methylisoxazole
Similar compounds
3-Isoxazolamine1750-42-133 % similar
3-Amino-5-methylpyrazole31230-17-833 % similar
2-Amino-4-methylpyridine695-34-132 % similar
4,5-Dimethyl-3-isoxazolamine13999-39-830 % similar
2-Amino-5-methylpyridine1603-41-430 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds