CHEMICAL AND PHYSICAL PROPERTIES
Physical Description | Solid |
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Melting Point | 215-217 °C |
Solubility | 31.4 mg/L |
LogP | 2.55 |
Stability/Shelf Life | Bulk: A sample stored at 60 °C for 30 days showed no decomposition (UV, HPLC). Solution: A solution in 5% methanol (0.5 mg/mL) showed no decomposition after 9 days (UV). A solution in 5% dimethylacetamide /pH 4 acetate buffer showed no decomposition after 48 hours(HPLC). |
Dissociation Constants | 8.0 |
Other Experimental Properties | Crystals from aqueous acetic acid; mp: 215-217 °C; poorly sol in water. /Trimetrexate monoacetate monohydrate/ |
SAFETY INFORMATION
Signal word | Warning |
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Pictogram(s) |
Exclamation Mark Irritant GHS07 |
GHS Hazard Statements |
H302:Acute toxicity,oral H315:Skin corrosion/irritation H319: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. 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 | 369.4 g/mol |
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XLogP3 | 2.5 |
Hydrogen Bond Donor Count | 3 |
Hydrogen Bond Acceptor Count | 8 |
Rotatable Bond Count | 6 |
Exact Mass | 369.18008961 g/mol |
Monoisotopic Mass | 369.18008961 g/mol |
Topological Polar Surface Area | 118 Ų |
Heavy Atom Count | 27 |
Formal Charge | 0 |
Complexity | 457 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 0 |
Undefined Atom Stereocenter Count | 0 |
Defined Bond Stereocenter Count | 0 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 1 |
Compound Is Canonicalized | Yes |
PRODUCT INTRODUCTION
description
Trimetrexate is a member of quinazolines. It has a role as an antifungal drug.