2-Amino-4-methyloxazole

C₄H₆N₂OCAS 35629-70-098.11 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₄H₆N₂O
Molar mass: 98.11 g/mol
Exact mass: 98.0480 Da
logP: 0.57Crippen estimate
Polar surface area: 52.0 Å²
H-bond donors / acceptors: 1 / 3
Rotatable bonds: 0

Hazards

Danger

H302+H312+H332 Harmful if swallowed, in contact with skin or if inhaled12.5% of notifiers
H302 Harmful if swallowed50% of notifiers
H312 Harmful in contact with skin12.5% of notifiers
H315 Causes skin irritation75% of notifiers
H318 Causes serious eye damage37.5% of notifiers
H319 Causes serious eye irritation37.5% of notifiers
H332 Harmful if inhaled25% of notifiers
H335 May cause respiratory irritation75% of notifiers

Aggregated from 8 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, P305+P354+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number

35629-70-0

SMILES

CC1=COC(=N1)N

InChIKey

VCZJVXLWQTXSPQ-UHFFFAOYSA-N

InChI

InChI=1S/C4H6N2O/c1-3-2-7-4(5)6-3/h2H,1H3,(H2,5,6)

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

1 names

4-Methyloxazol-2-amine

Work with 2-Amino-4-methyloxazole

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

2,4-Dimethyloxazole7208-05-152 % similar 2-Amino-4-(trifluoromethyl)oxazole35629-71-143 % similar Ethyl 2-amino-1,3-oxazole-4-carboxylate177760-52-037 % similar 2-Amino-6-methylpyridine1824-81-333 % similar 6-Methyl-2-pyrazinamine5521-56-233 % similar 2,6-Dimethyl-3-pyridylamine3430-33-932 % similar 2-Amino-4,6-dimethylpyridine5407-87-432 % similar 4-Methyloxazole693-93-632 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

3-Amino-5-methylisoxazole1072-67-9 3-Methyl-2-pyrazolin-5-one108-26-9 1,3-Dihydro-4-methyl-2H-imidazol-2-one1192-34-3 5-Amino-3-methylisoxazole14678-02-5 (1H-Pyrazol-3-yl)methanol23585-49-1 1H-Pyrazole-4-methanol25222-43-9 1-Methyl-1H-pyrazol-5-ol33641-15-5 1H-Imidazole-2-methanol3724-26-3

Elsewhere

PubChem CAS Common Chemistry NIST WebBook