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| CAS No.: | 14807-75-1 |
|---|---|
| Name: | Formamidine disulfide dihydrochloride |
| Molecular Structure: | |
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| Formula: | C2H6N4S2.2(HCl) |
| Molecular Weight: | 223.15 |
| Synonyms: | Formamidine,1,1'-dithiodi-, dihydrochloride (7CI,8CI);Thioperoxydicarbonimidic diamide([(H2N)C(NH)]2S2), dihydrochloride (9CI);1,1'-Dithiodiformamidinehydrochloride;C,C'-Dithiodiformamidinium dichloride;Diformamidine disulfidedihydrochloride;Dithiobis[diaminomethylcarbonium chloride];a,a'-Dithiobisformamidinium dichloride;Dithioformamidine dihydrochloride; |
| EINECS: | 238-876-3 |
| Density: | 1.86 g/cm3 |
| Melting Point: | 175-180 °C(lit.) |
| Boiling Point: | 287.1 °C at 760 mmHg |
| Flash Point: | 127.4 °C |
| Solubility: | Soluble in water. |
| Appearance: | white to light yellow fine crystalline powder |
| Hazard Symbols: | Xi |
| Risk Codes: | 36/37/38 |
| Safety: | 24/25-36/37/39-27-26 |
| PSA: | 150.34000 |
| LogP: | 3.35880 |
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Consensus Reports
Reported in EPA TSCA Inventory.
Specification
The Formamidine disulfide dihydrochloride, with the CAS registry number 14807-75-1, is also known as Dithioformamidine dihydrochloride. Its EINECS number is 238-876-3. This chemical's molecular formula is C2H6N4S2.2(HCl) and molecular weight is 223.15. What's more, its systematic name is alpha,alpha'-Dithiobisformamidine hydrochloride. This chemical is stable at common pressure and temperature, and it should be sealed and stored in a ventilated and dry place. Moreover, it should be protected from oxides and light. It is used as chemical reagents, organic intermediates and fine chemicals, and it is also used in pharmaceutical research and development.
Physical properties of Formamidine disulfide dihydrochloride are: (1)ACD/LogP: -0.368; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): -2.10; (4)ACD/LogD (pH 7.4): -0.51; (5)ACD/BCF (pH 5.5): 1.00; (6)ACD/BCF (pH 7.4): 1.00; (7)ACD/KOC (pH 5.5): 1.00; (8)ACD/KOC (pH 7.4): 10.77; (9)#H bond acceptors: 4; (10)#H bond donors: 6; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 75.32 Å2; (13)Flash Point: 127.4 °C; (14)Enthalpy of Vaporization: 52.63 kJ/mol; (15)Boiling Point: 287.1 °C at 760 mmHg; (16)Vapour Pressure: 0.00253 mmHg at 25°C.
When you are using this chemical, please be cautious about it as the following:
This chemical is irritating to eyes, respiratory system and skin. In case of contact with eyes, you should rinse immediately with plenty of water and seek medical advice. When using it, you need wear suitable protective clothing, gloves and eye/face protection and must avoid contact with eyes. You should take off immediately all contaminated clothing.
You can still convert the following datas into molecular structure:
(1)SMILES: [Cl-].[Cl-].[N@H]=C(SSC(=[N@H])[NH3+])[NH3+]
(2)Std. InChI: InChI=1S/C2H6N4S2.2ClH/c3-1(4)7-8-2(5)6;;/h(H3,3,4)(H3,5,6);2*1H
(3)Std. InChIKey: BFJQSCVWXZOXGK-UHFFFAOYSA-N
The toxicity data is as follows:
| Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
|---|---|---|---|---|---|
| mouse | LD50 | intraperitoneal | 100mg/kg (100mg/kg) | National Technical Information Service. Vol. AD277-689. |