Name | hexetidine |
Synonyms | 141-94-6 hexetidine HEXETIDINE Hexopyrimidine LABOTEST-BB LT00134693 hexetidine,mixtureofstereoisomers 1,3-bis(2-ethylhexyl)hexahydro-5-methyl-5-pyrimidinamin 1,3-Bis(2-ethylhexyl)hexahydro-5-methyl-5-pyrimidinamine 1,3-bis(2-ethylhexyl)hexahydro-5-methyl-5-Pyrimidinamine 1,3-Bis(2-ethylhexyl)-5-methylhexahydropyrimidin-5-amine 1,3-Bis(b-ethylhexyl)-5-methyl-5-aminohexahydropyrimidine 5-AMINO-1,3-BIS(2-ETHYLHEXYL)HEXAHYDRO-5-METHYLPYRIMIDINE 5-pyrimidinamine, 1,3-bis(2-ethylhexyl)hexahydro-5-methyl- hexetidine,5-amino-1,3-bis(2-ethylhexyl)hexahydro-5-methylpyrimidine 5-Amino-1,3-bis(2-ethylhexyl)hexahydro-5-methylpyrimidine, mix of diastereomers |
CAS | 141-94-6 |
EINECS | 205-513-5 |
InChI | InChI=1/C21H45N3/c1-6-10-12-19(8-3)14-23-16-21(5,22)17-24(18-23)15-20(9-4)13-11-7-2/h19-20H,6-18,22H2,1-5H3 |
InChIKey | DTOUUUZOYKYHEP-UHFFFAOYSA-N |
Molecular Formula | C21H45N3 |
Molar Mass | 339.6 |
Density | 0.889 g/mL at 25 °C (lit.) |
Melting Point | 25°C |
Boling Point | 160 °C/0.4 mmHg (lit.) |
Flash Point | 70°C |
Water Solubility | Not miscible or difficult to mix in water. |
Solubility | acetone: soluble(lit.) |
Vapor Presure | 3.11E-06mmHg at 25°C |
Appearance | neat |
Color | Clear Colourless |
Merck | 14,4703 |
BRN | 161071 |
pKa | 8.3(at 25℃) |
Storage Condition | 2-8°C |
Refractive Index | 1.4649 |
MDL | MFCD00010428 |
Hazard Symbols | Xi - Irritant |
Risk Codes | R36/38 - Irritating to eyes and skin. R36/37/38 - Irritating to eyes, respiratory system and skin. |
Safety Description | S26 - In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. S36 - Wear suitable protective clothing. |
WGK Germany | 3 |
TSCA | Yes |
Hazard Note | Irritant |
1mg | 5mg | 10mg | |
---|---|---|---|
1 mM | 2.945 ml | 14.723 ml | 29.446 ml |
5 mM | 0.589 ml | 2.945 ml | 5.889 ml |
10 mM | 0.294 ml | 1.472 ml | 2.945 ml |
5 mM | 0.059 ml | 0.294 ml | 0.589 ml |
EPA chemical information | Information provided by: ofmpub.epa.gov (external link) |
biological activity | Hexetidine is an anti-bacterial and anti-fungal agent with local anesthesia, hemostasis, deodorization and prevention of dental plaque. |
toxic substance data | information provided by: pubchem.ncbi.nlm.nih.gov (external link) |