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Name |
Dimatif |
EINECS | N/A |
CAS No. | 14465-96-4 | Density | 1.5g/cm3 |
PSA | 73.94000 | LogP | 1.02750 |
Solubility | N/A | Melting Point |
N/A |
Formula | C4H10 N3 P S | Boiling Point | 265.6°Cat760mmHg |
Molecular Weight | 163.20 | Flash Point | 114.4°C |
Transport Information | N/A | Appearance | N/A |
Safety | Poison by ingestion. An experimental teratogen. Other experimental reproductive effects. Human mutation data reported. When heated to decomposition it emits toxic fumes of POx, NOx, and SOx. | Risk Codes | N/A |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
AI 3-61969;Amido(thio)phosphoric acid diethylenimide; Aziridine,1,1'-(aminophosphinothioylidene)bis-; Diethyleneimideamidothiophosphoric acid;Dimatif; ENT 61969 |
Molecule structure of Dimatif (CAS NO.14465-96-4) :
IUPAC Name: 1-[amino(aziridin-1-yl)phosphinothioyl]aziridine
Molecular Weight: 163.181061 g/mol
Molecular Formula: C4H10N3PS
Density: 1.5 g/cm3
Boiling Point: 265.6 °C at 760 mmHg
Flash Point: 114.4 °C
Index of Refraction: 1.691
Molar Refractivity: 41.6 cm3
Molar Volume: 108.6 cm3
Polarizability: 16.49×10-24 cm3
Surface Tension: 81.1 dyne/cm
Enthalpy of Vaporization: 50.35 kJ/mol
Vapour Pressure: 0.0091 mmHg at 25 °C
XLogP3-AA: 0.4
H-Bond Donor: 1
H-Bond Acceptor: 3
Rotatable Bond Count: 2
Tautomer Count: 2
Exact Mass: 163.033305
MonoIsotopic Mass: 163.033305
Topological Polar Surface Area: 32
Heavy Atom Count: 9
Complexity: 159
Canonical SMILES: C1CN1P(=S)(N)N2CC2
InChI: InChI=1S/C4H10N3PS/c5-8(9,6-1-2-6)7-3-4-7/h1-4H2,(H2,5,9)
InChIKey of Dimatif (CAS NO.14465-96-4) : RXZRAOONKFIKQQ-UHFFFAOYSA-N
1. | mmo-smc 1 mg/L | TGANAK Tsitologiya i Genetika. 18 (1984),455. | ||
2. | cyt-hmn:lym 400 mg/L | TGANAK Tsitologiya i Genetika. 18 (1984),455. | ||
3. | sce-hmn:lym 2 mg/L | TGANAK Tsitologiya i Genetika. 16 (2)(1982),34. | ||
4. | cyt-mus-unr 1 mg/kg | TGANAK Tsitologiya i Genetika. 18 (1984),455. | ||
5. | orl-rat LD50:66 mg/kg | GISAAA Gigiena i Sanitariya. 48 (5)(1983),75. | ||
6. | orl-qal LD50:100 mg/kg | JRPFA4 Journal of Reproduction and Fertility. 48 (1976),371. |
Poison by ingestion. An experimental teratogen. Other experimental reproductive effects. Human mutation data reported. When heated to decomposition it emits toxic fumes of POx, NOx, and SOx.
Dimatif (CAS NO.14465-96-4) is also named as Dimatiph ; AI3-61969 ; Bis(1-aziridinyl)aminophospine sulfide ; ENT 61969 ; P,P-Bis(1-aziridinyl)phosphinothioic amide ; Phosphine sulfide, bis(1-aziridinyl)amino- ; Phosphinothioic amide, P,P-bis(1-aziridinyl)- .