S4026
Semustine
Synonym(s):
N-(2-Chloroethyl)-N′-(4-methylcyclohexyl)-N-nitrosourea, Methyl-CCNU
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About This Item
Empirical Formula (Hill Notation):
C10H18ClN3O2
CAS Number:
Molecular Weight:
247.72
NACRES:
NA.22
PubChem Substance ID:
UNSPSC Code:
12352100
MDL number:
SMILES string
CC1CCC(CC1)NC(=O)N(CCCl)N=O
InChI
1S/C10H18ClN3O2/c1-8-2-4-9(5-3-8)12-10(15)14(13-16)7-6-11/h8-9H,2-7H2,1H3,(H,12,15)
InChI key
FVLVBPDQNARYJU-UHFFFAOYSA-N
Application
Commonly used in pharmacological studies involving:
- Nutrient-sensitized screening for drugs that shift the energy metabolism from mitchondrial respiration to glycolysis
- CEOP regimen with semustine used as induction chemotherapy in patients with lymphoma
- Investigations into its use for chemotherapy
signalword
Danger
Hazard Classifications
Acute Tox. 2 Oral - Acute Tox. 3 Dermal - Acute Tox. 3 Inhalation - Carc. 1B - Eye Irrit. 2 - Repr. 1B - Skin Irrit. 2 - STOT SE 3
target_organs
Respiratory system
Storage Class
6.1A - Combustible acute toxic Cat. 1 and 2 / very toxic hazardous materials
wgk
WGK 3
flash_point_f
Not applicable
flash_point_c
Not applicable
ppe
Eyeshields, Faceshields, Gloves, type P3 (EN 143) respirator cartridges
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Global Trade Item Number
| SKU | GTIN |
|---|---|
| S4026-100MG | 04061832857862 |