19408-46-9
Product Name:
Kasugamycin hydrochloride
Formula:
C14H25N3O9.ClH
Synonyms:
3-O-[2-Amino-4-[(carboxyiminomethyl)amino]-2,3,4,6-tetradeoxy-D -arabino-hexopyranosyl]-D -chiro-inositol hydrochloride;3-O-[2-Amino-4-[(carboxyiminomethyl)amino]-2,3,4,6-tetradeoxy-D -arabino-hexopyranosyl]-D -chiro-inositol
Inquiry
CHEMICAL AND PHYSICAL PROPERTIES
| Melting Point | 203 °C (dec) |
|---|---|
| Vapor Pressure | <1.3X10-4 mm Hg at 25 °C |
| Decomposition | When heated to decomposition it emits toxic vapors of /nitrogen oxides/. |
| Dissociation Constants | pKa1 = 3.23 /carboxylic acid/; pKa2 = 7.73 /cyclic primary amine/; pKa3 = 11.0 /secondary amine/ |
| Collision Cross Section | 185.4 Ų [M+H]+ [CCS Type: TW, Method: calibrated with polyalanine and drug standards] |
| Other Experimental Properties | Physicochemical properties of the technical grade compound (Kasugamycin hydrochloride hydrate). [Table#6184] |
| Chemical Classes | Pesticides -> Fungicides |
SAFETY INFORMATION
| Signal word | Warning |
|---|---|
| Pictogram(s) |
 Exclamation Mark Irritant GHS07 |
| GHS Hazard Statements |
H302:Acute toxicity,oral H315:Skin corrosion/irritation H320:Serious eye damage/eye irritation H335:Specific target organ toxicity, single exposure;Respiratory tract irritation |
| Precautionary Statement Codes |
P261:Avoid breathing dust/fume/gas/mist/vapours/spray. P280:Wear protective gloves/protective clothing/eye protection/face protection. P301+P312:IF SWALLOWED: call a POISON CENTER or doctor/physician IF you feel unwell. P302+P352:IF ON SKIN: wash with plenty of soap and water. P305+P351+P338:IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing. |
COMPUTED DESCRIPTORS
| Molecular Weight | 415.82 g/mol |
|---|---|
| Hydrogen Bond Donor Count | 9 |
| Hydrogen Bond Acceptor Count | 11 |
| Rotatable Bond Count | 4 |
| Exact Mass | 415.1357571 g/mol |
| Monoisotopic Mass | 415.1357571 g/mol |
| Topological Polar Surface Area | 221 Ų |
| Heavy Atom Count | 27 |
| Formal Charge | 0 |
| Complexity | 532 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 8 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 2 |
| Compound Is Canonicalized | Yes |