N'-(2-chloroethyl)-N-(2-(methylsulfinyl)ethyl)-N'-nitrosourea (CAS 96413-13-7) — formula C6H12ClN3O3S, molecular weight 241.70; category organic chemicals.
| CAS Number | 96413-13-7 |
|---|---|
| Molecular Formula | C6H12ClN3O3S |
| Molecular Weight | 241.70 |
| LogP | 0 |
| Category | Organic Chemicals |
N'-(2-chloroethyl)-N-(2-(methylsulfinyl)ethyl)-N'-nitrosourea is a carbon-based organic compound with CAS registry number 96413-13-7 and molecular formula C6H12ClN3O3S (molecular weight 241.70), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 96413-13-7
Its molecular formula C6H12ClN3O3S comprises 6 C, 12 H, 1 Cl, 3 N, 3 O, 1 S atoms.
Also known as: N'-(2-chloroethyl)-N-(2-(methylsulfinyl)ethyl)-N'-nitrosourea · N'-(2-氯乙基)-N-(2-(甲基亚磺酰基)乙基)-N'-亚硝基脲
Category: organic chemicals
The CAS registry number of N'-(2-chloroethyl)-N-(2-(methylsulfinyl)ethyl)-N'-nitrosourea is 96413-13-7.
Molecular formula C6H12ClN3O3S, molecular weight 241.70.
It is also registered under: N'-(2-chloroethyl)-N-(2-(methylsulfinyl)ethyl)-N'-nitrosourea, N'-(2-氯乙基)-N-(2-(甲基亚磺酰基)乙基)-N'-亚硝基脲.
Category: Organic Chemicals.
Independent reference data for N'-(2-chloroethyl)-N-(2-(methylsulfinyl)ethyl)-N'-nitrosourea (CAS 96413-13-7), compiled from public chemistry databases.
| CAS 号 | 96413-13-7 |
|---|---|
| PubChem CID | 125952 |
| 分子式 | C6H12ClN3O3S |
| IUPAC 名称 | 1-(2-chloroethyl)-3-(2-methylsulfinylethyl)-1-nitrosourea |
| Molecular Weight | 241.70 |
|---|---|
| XLogP3 | 0 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 5 |
| Exact Mass | 241.0287901 |
| Monoisotopic Mass | 241.0287901 |
| Topological Polar Surface Area | 98.1 |
| Heavy Atom Count | 14 |
96413-13-7; N'-(2-Chloroethyl)-N-(2-(methylsulfinyl)ethyl)-N'-nitrosourea; RefChem:160557; perrimustine; 1-(2-Chloroethyl)-3-(2-(methylsulfinyl)ethyl)-1-nitrosourea; BRN 5537700; N-(2-Chloroethyl)-N'-(2-(methylsulfinyl)ethyl)-N-nitrosourea; CHEMBL27414; DTXSID70914524; Urea, N-(2-chloroethyl)-N'-(2-(methylsulfinyl)ethyl)-N-nitroso-; N-(N'-(2-chloroethyl)-N'-nitrosocarbamoyl)-S-methylcysteamine sulfoxide; N-(2-Chloroethyl)-N'-[2-(methanesulfinyl)ethyl]-N-nitrosocarbamimidic acid
N'-(2-氯乙基)-N-(2-(甲基亚磺酰基)乙基)-N'-亚硝基脲 · CAS 96413-13-7 · C6H12ClN3O3S.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.