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| CAS No.: | 4148-16-7 |
|---|---|
| Name: | Ritrosulfan |
| Molecular Structure: | |
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| Formula: | C10H24 N2 O8 S2 |
| Molecular Weight: | 364.441 |
| Synonyms: | 3,14-Dioxa-2,15-dithia-6,11-diazahexadecane-8,9-diol,2,2,15,15-tetraoxide, (R*,S*)-; Erythritol,1,4-dideoxy-1,4-bis[(2-hydroxyethyl)amino]-, 1,4-dimethanesulfonate (ester),meso- (7CI,8CI); 1,4-Bis(2'-mesyloxyethylamino)-1,4-dideoxymesoerythritol;Lycurim; Lykurim; NSC 122402; Ritrosulfan; meso-1,4-Dideoxy-1,4-bis[(2-hydroxyethyl)amino]erythritol1,4-dimethanesulfonate |
| Density: | 1.392g/cm3 |
| Boiling Point: | 647.6°Cat760mmHg |
| Flash Point: | 345.4°C |
| Safety: | Poison by ingestion and intraperitoneal routes. Mutation data reported. When heated to decomposition it emits toxic fumes of SOx and NOx. |
| PSA: | 168.02000 |
| LogP: | -0.21680 |
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Chemistry
Product Name: Ritrosulfan (CAS NO.4148-16-7)
Molecular Formula: C10H24N2O8S2
Molecular Weight: 364.48g/mol
Mol File: 4148-16-7.mol
Boiling point: 647.6 °C at 760 mmHg
Flash Point: 345.4 °C
Density: 1.392 g/cm3
Surface Tension: 57.1 dyne/cm
Enthalpy of Vaporization: 109.37 kJ/mol
Vapour Pressure: 1.66E-19 mmHg at 25°C
XLogP3-AA: -3
H-Bond Donor: 4
H-Bond Acceptor: 10
Structure Descriptors of Ritrosulfan (CAS NO.4148-16-7):
IUPAC Name: 2-[[2,3-dihydroxy-4-(2-methylsulfonyloxyethylamino)butyl]amino]ethylmethanesulfonate
Canonical SMILES: CS(=O)(=O)OCCNCC(C(CNCCOS(=O)(=O)C)O)O
InChI: InChI=1S/C10H24N2O8S2/c1-21(15,16)19-5-3-11-7-9(13)10(14)8-12-4-6-20-22(2,17)18/h9-14H,3-8H2,1-2H3
InChIKey: BYZJBHCTZJGJFV-UHFFFAOYSA-N
Toxicity Data With Reference
| 1. | mmo-sat 10 mg/plate | CNREA8 Cancer Research. 43 (1983),4530. | ||
| 2. | sce-ham:oth 1300 ng/L | CNREA8 Cancer Research. 43 (1983),4530. | ||
| 3. | orl-mus LD50:113 mg/kg | NCISP* National Cancer Institute Screening Program Data Summary, Developmental Therapeutics Program, Bethesda, MD 20205 JAN86 . | ||
| 4. | ipr-mus LD50:54,210 µg/kg | NCISP* National Cancer Institute Screening Program Data Summary, Developmental Therapeutics Program, Bethesda, MD 20205 JAN86 . |
Safety Profile
Poison by ingestion and intraperitoneal routes. Mutation data reported. When heated to decomposition it emits toxic fumes of SOx and NOx.
Specification
Ritrosulfan ,its CAS NO. is 4148-16-7,the synonyms is 1,4-(Methylsulfonyloxyethylamino)-1,4-dideoxy-erythrioldimethylsulfonate ; 1,4-Bis(2'-mesyloxyethylamino)-1,4-dideoxymesoerythritol ; 1,4-Di(mesyloxyethylamino)erythritol ; 1,4-Dideoxy-1,4-bis((2-hydroxyethyl)amino)erythritol 1,4-dimethanesulfonate (ester) ; Lycurim ; Lykurim ; R 74 base ; Ritrosulfanum ; UNII-YIY0662KX9 ; erythro-5,6-Dihydroxy-3,8-diazadecan-1,10-diyl bis(methansulfonat) ; 3,14-Dioxa-2,15-dithia-6,11-diazahexadecane-8,9-diol, 2,2,15,15-tetraoxide, (8R,9S)-rel- ; 3,14-Dioxa-2,15-dithia-6,11-diazahexadecane-8,9-diol, 2,2,15,15-tetraoxide, (R*,S*)- (9CI) ; Erythritol, 1,4-dideoxy-1,4-bis((2-hydroxyethyl)amino)-, 1,4-dimethanesulfonate (ester), meso- .