2-Chloro-4,6-dimethoxy-1,3,5-triazine

C₅H₆ClN₃O₂CAS 3140-73-6175.57 g/mol

Open in Covalent MOL file

Aryl halide Ether

Properties

Molecular formula: C₅H₆ClN₃O₂
Molar mass: 175.57 g/mol
Exact mass: 175.0149 Da
Melting point: 75–76 °C
logP: 0.54Crippen estimate
Polar surface area: 57.1 Å²
H-bond donors / acceptors: 0 / 5
Rotatable bonds: 2

Hazards

Danger

H302 Harmful if swallowed53.2% of notifiers
H315 Causes skin irritation94.6% of notifiers
H317 May cause an allergic skin reaction52.3% of notifiers
H318 Causes serious eye damage52.3% of notifiers
H319 Causes serious eye irritation48.6% of notifiers
H335 May cause respiratory irritation51.4% of notifiers
H411 Toxic to aquatic life with long lasting effects53.2% of notifiers

Aggregated from 111 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P270, P271, P272, P273, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P305+P354+P338, P317, P319, P321, P330, P332+P317, P333+P317, P337+P317, P362+P364, P391, P403+P233, P405, P501

Identifiers

CAS number

3140-73-6

SMILES

COc1nc(Cl)nc(OC)n1

InChIKey

GPIQOFWTZXXOOV-UHFFFAOYSA-N

InChI

InChI=1S/C5H6ClN3O2/c1-10-4-7-3(6)8-5(9-4)11-2/h1-2H3

Weigh it out

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

Names and synonyms

10 names

1,3,5-Triazine, 2-chloro-4,6-dimethoxy-
s-Triazine, 2-chloro-4,6-dimethoxy-
2-Chloro-4,6-dimethoxy-s-triazine
2,4-Dimethoxy-6-chloro-s-triazine
6-Chloro-2,4-dimethoxy-s-triazine
2,4-Dimethoxy-6-chloro-1,3,5-triazine
4,6-Dimethoxy-2-chloro-s-triazine
NSC 46520
CDMT
Chlorodimethoxytriazine

Work with 2-Chloro-4,6-dimethoxy-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

2,4-Dichloro-6-methoxy-1,3,5-triazine3638-04-889 % similar 2-Methoxy-4,6-dichloropyrimidine1074-40-458 % similar 2-Chloro-4,6-dimethoxypyrimidine13223-25-154 % similar 2-Amino-4,6-dimethoxy-1,3,5-triazine16370-63-152 % similar 2,4,6-Trimethoxypyrimidine13106-85-950 % similar 4-Chloro-2,6-dimethoxypyrimidine6320-15-650 % similar 2-Chloro-5-methoxypyrimidine22536-65-842 % similar Cyanuric chloride108-77-042 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

5-Chloro-1,3-dimethyl-4-nitro-1H-pyrazole13551-73-0

Elsewhere

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