CAS 108-74-7|1,3,5-trimethyl-1,3,5-triazinane|TRIMETHYLCYCLOTRIMETHYLENETRIAMINE|1,3,5-trimethyl-1,3,5-triazinane|1,3,5-trimethyl-1,3,5-triazinane|1,3,5-Trimethylhexahydro-1,3,5-triazine|1,3,5-三甲基...

Molecular Formula

C₆H₁₅N₃

Molecular Mass

129.2034

Exact Mass

129.1265975

InChI

InChI=1S/C6H15N3/c1-7-4-8(2)6-9(3)5-7/h4-6H2,1-3H3

InChIKey

DPMZXMBOYHBELT-UHFFFAOYSA-N

Canonic Smiles

CN1CN(C)CN(C1)C

Isomeric Smiles

CN1CN(C)CN(C)C1

JChem

H Acceptors

H Donor

LogD (pH = 5.5)

0.22387214

LogD (pH = 7.4)

0.38376516

Log P

0.3862364

Molar Refractivity

38.4858

Polarizability

15.640824

Polar Surface Area

9.72

Rotatable Bonds

Lipinski's Rule of Five

true

Academic Data

PubChem

7952

IUPAC name

1,3,5-trimethyl-1,3,5-triazinane

Synonyms

TRIMETHYLCYCLOTRIMETHYLENETRIAMINE1,3,5-trimethyl-1,3,5-triazinane1,3,5-Trimethylhexahydro-1,3,5-triazine1,3,5-三甲基六氢-1,3,5-三嗪Hexahydro-1,3,5-trimethyl-1,3,5-triazine六氢-1,3,5-三甲基-1,3,5-三嗪

IUPAC Traditional name

1,3,5-trimethyl-1,3,5-triazinane

PubChem SID

16210308824855400

MDL Number

MFCD00006057

RTECS

XY9300000

MSDS Link

Download link

GHS Pictograms

Flammable gases, category 1

Flammable aerosols, categories 1,2

Flammable liquids, categories 1,2,3

Self-reactive substances and mixtures, Types B,C,D,E,F

Pyrophoric liquids, category 1

Pyrophoric solids, category 1

Self-heating substances and mixtures

Substances and mixtures, which in contact with water, emit flammable gases, categories 1,2,3

Organic peroxides, Types B,C,D,E,F

Acute toxicity (oral, dermal, inhalation), category 4

Skin irritation, category 2

Eye irritation, category 2

Skin sensitisation, category 1

Specific Target Organ Toxicity – Single exposure, category 3

Eyeshields, Faceshields, full-face respirator (US), Gloves, multi-purpose combination respirator cartridge (US), type ABEK (EN14387) respirator filter