1,3,5-Trimethyl-1,3,5-triazinane
Properties
- Molecular formula
- C6H15N3
- Molar mass
- 129.21 g/mol
- Exact mass
- 129.1266 Da
- Boiling point
- 155–160 °C
- logP
- -0.33Crippen estimate
- Polar surface area
- 9.7 Ų
- H-bond donors / acceptors
- 0 / 3
- Rotatable bonds
- 0
Hazards
Danger
- H226 Flammable liquid and vapor82.4% of notifiers
- H302 Harmful if swallowed97.3% of notifiers
- H314 Causes severe skin burns and eye damage95.9% of notifiers
- H317 May cause an allergic skin reaction95.9% of notifiers
- H318 Causes serious eye damage44.6% of notifiers
- H335 May cause respiratory irritation27% of notifiers
- H373 May causes damage to organs through prolonged or repeated exposure85.1% of notifiers
- H412 Harmful to aquatic life with long lasting effects95.9% of notifiers
Aggregated from 74 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P210, P233, P240, P241, P242, P243, P260, P261, P264, P264+P265, P270, P271, P272, P273, P280, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P303+P361+P353, P304+P340, P305+P354+P338, P316, P317, P319, P321, P330, P333+P317, P362+P364, P363, P370+P378, P403+P233, P403+P235, P405, P501
Identifiers
CAS number
108-74-7SMILES
CN1CN(C)CN(C)C1InChIKey
DPMZXMBOYHBELT-UHFFFAOYSA-NInChI
InChI=1S/C6H15N3/c1-7-4-8(2)6-9(3)5-7/h4-6H2,1-3H3Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
12 names
- 1,3,5-Triazine, hexahydro-1,3,5-trimethyl-
- s-Triazine, hexahydro-1,3,5-trimethyl-
- Hexahydro-1,3,5-trimethyl-1,3,5-triazine
- 1,3,5-Trimethylhexahydro-s-triazine
- 1,3,5-Trimethylhexahydro-1,3,5-triazine
- Hexahydro-1,3,5-trimethyl-s-triazine
- F 7771
- 1,3,5-Trimethyltrimethylenetriamine
- N,N′,N′′-Trimethyl-1,3,5-triazacyclohexane
- NSC 166326
- 1,3,5-Trimethyl-1,3,5-triazacyclohexane
- 1,3,5-Trimethylhexahydrotriazine
Work with 1,3,5-Trimethyl-1,3,5-triazinane
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
Boiling point under vacuumAt any pressure, from its normal boiling point
Isotope patternExact mass and the mass spectrum pattern
Similar compounds
1,4-Dimethylpiperazine106-58-150 % similar
1-Methylpyrrolidine120-94-543 % similar
N,N-Diethylmethylamine616-39-743 % similar
1,4,8,11-Tetramethyl-1,4,8,11-tetraazacyclotetradecane41203-22-940 % similar
N-Methylpiperidine626-67-540 % similar
Bis(dimethylamino)methane51-80-938 % similar
PMDTA3030-47-538 % similar
Hexamethyltriethylenetetramine3083-10-138 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds