-
Name
CARBAMIC ACID, (BIS(1-AZIRIDINYL)PHOSPHINYL-, 1,2,3-PROPANETRIYL ESTER
- EINECS
- CAS No. 28613-21-0
- Density 1.7g/cm3
- Solubility
- Melting Point
- Formula C18H32 N9 O9 P3
- Boiling Point °Cat760mmHg
- Molecular Weight 611.50
- Flash Point °C
- Transport Information
- Appearance
- Safety A poison by subcutaneous route. When heated to decomposition it emits toxic vapors of POx and NOx.
- Risk Codes
-
Molecular Structure
- Hazard Symbols
- Synonyms Glycerol,tris[[bis(1-aziridinyl)phosphinyl]carbamate] (8CI)
- PSA
- LogP
Carbamic acid, (bis(1-aziridinyl)phosphinyl)-, 1,2,3-propanetriyl ester Chemical Properties
IUPAC Name: 1,3-bis[bis(Aziridin-1-yl)phosphorylcarbamoyloxy]propan-2-yl N-[bis(aziridin-1-yl)phosphoryl]carbamate
Synonyms of Carbamic acid, (bis(1-aziridinyl)phosphinyl)-, 1,2,3-propanetriyl ester (CAS NO.28613-21-0): 1,2,3-Propanetriyl (bis(1-aziridinyl)phosphinyl)carbamate
InChI: InChI=1/C18H32N9O9P3/c28-16(19-37(31,22-1-2-22)23-3-4-23)34-13-15(36-18(30)21-39(33,26-9-10-26)27-11-12-27)14-35-17(29)20-38(32,24-5-6-24)25-7-8-25/h15H,1-14H2,(H,19,28,31)(H,20,29,32)(H,21,30,33)
InChIKey: PNMGXUKOVGRSIA-UHFFFAOYAU
Std. InChI: InChI=1S/C18H32N9O9P3/c28-16(19-37(31,22-1-2-22)23-3-4-23)34-13-15(36-18(30)21-39(33,26-9-10-26)27-11-12-27)14-35-17(29)20-38(32,24-5-6-24)25-7-8-25/h15H,1-14H2,(H,19,28,31)(H,20,29,32)(H,21,30,33)
Std. InChIKey: PNMGXUKOVGRSIA-UHFFFAOYSA-N
CAS NO: 28613-21-0
Molecular Formula: C18H32N9O9P3
Molecular Weight: 611.4229
Molecular Structure : .png)
H bond acceptors: 18
H bond donors: 3
Freely Rotating Bonds: 14
Polar Surface Area: 187.32 Å2
Index of Refraction: 1.665
Molar Refractivity: 133.16 cm3
Molar Volume: 358.2 cm3
Surface Tension: 90.6 dyne/cm
Density: 1.7 g/cm3
Carbamic acid, (bis(1-aziridinyl)phosphinyl)-, 1,2,3-propanetriyl ester Toxicity Data With Reference
| Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
|---|---|---|---|---|---|
| mouse | LD50 | subcutaneous | 220mg/kg (220mg/kg) | LIVER: "HEPATITIS (HEPATOCELLULAR NECROSIS), ZONAL" KIDNEY, URETER, AND BLADDER: "CHANGES IN TUBULES (INCLUDING ACUTE RENAL FAILURE, ACUTE TUBULAR NECROSIS)" BLOOD: CHANGES IN SPLEEN | Farmakologiya i Toksikologiya Vol. 8, Pg. 73, 1973. |
| rat | LD50 | subcutaneous | 275mg/kg (275mg/kg) | LIVER: "HEPATITIS (HEPATOCELLULAR NECROSIS), ZONAL" KIDNEY, URETER, AND BLADDER: "CHANGES IN TUBULES (INCLUDING ACUTE RENAL FAILURE, ACUTE TUBULAR NECROSIS)" BLOOD: CHANGES IN SPLEEN | Farmakologiya i Toksikologiya Vol. 8, Pg. 73, 1973. |
Carbamic acid, (bis(1-aziridinyl)phosphinyl)-, 1,2,3-propanetriyl ester Safety Profile
A poison by subcutaneous route. When Carbamic acid, (bis(1-aziridinyl)phosphinyl)-, 1,2,3-propanetriyl ester (CAS NO.28613-21-0) is heated to decomposition ,it emits toxic vapors of POx and NOx.
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