2-Amino-4-methoxy-6-methyl-1,3,5-triazine

C₅H₈N₄OCAS 1668-54-8140.15 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₅H₈N₄O
Molar mass: 140.15 g/mol
Exact mass: 140.0698 Da
Melting point: 256–257 °C
logP: -0.40Crippen estimate
Polar surface area: 74.7 Å²
H-bond donors / acceptors: 2 / 4
Rotatable bonds: 1

Hazards

Danger

H302 Harmful if swallowed100% of notifiers
H315 Causes skin irritation50.6% of notifiers
H319 Causes serious eye irritation50.6% of notifiers
H331 Toxic if inhaled15.7% of notifiers
H335 May cause respiratory irritation48.2% of notifiers
H336 May cause drowsiness or dizziness15.7% of notifiers
H373 May causes damage to organs through prolonged or repeated exposure15.7% of notifiers

Aggregated from 83 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P260, P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P316, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number

1668-54-8

SMILES

COc1nc(C)nc(=N)[nH]1

InChIKey

NXFQWRWXEYTOTK-UHFFFAOYSA-N

InChI

InChI=1S/C5H8N4O/c1-3-7-4(6)9-5(8-3)10-2/h1-2H3,(H2,6,7,8,9)

Weigh it out

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

Names and synonyms

11 names

1,3,5-Triazin-2-amine, 4-methoxy-6-methyl-
s-Triazine, 2-amino-4-methoxy-6-methyl-
4-Methoxy-6-methyl-1,3,5-triazin-2-amine
2-Methyl-4-amino-6-methoxy-s-triazine
CV 399
2-Methoxy-4-methyl-6-amino-1,3,5-triazine
A 4098
2-Amino-4-methyl-6-methoxy-s-triazine
2-Amino-4-methoxy-6-methyl-s-triazine
2-Amino-4-methyl-6-methoxy-1,3,5-triazine
IN-A 4098

Work with 2-Amino-4-methoxy-6-methyl-1,3,5-triazine

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

4-Methoxy-N,6-dimethyl-1,3,5-triazin-2-amine5248-39-555 % similar 2-Amino-4,6-dimethoxypyrimidine256642-28-143 % similar 2-Amino-4,6-dimethoxypyrimidine36315-01-243 % similar 4-Chloro-6-methoxy-2-pyrimidinamine5734-64-541 % similar 4,6-Dimethoxy-2-methylpyrimidine13566-48-839 % similar O-(6)-Methylguanine20535-83-538 % similar 2,4,6-Trimethyl-1,3,5-triazine823-94-938 % similar Acetoguanamine542-02-936 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

2,6-Diamino-4-methoxy pyrimidine3270-97-1 3-Methyl-1H-pyrazole-5-carbohydrazide40535-14-6

Elsewhere

PubChem CAS Common Chemistry NIST WebBook