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CAS No.: | 14484-64-1 |
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Name: | FERBAM |
Article Data: | 9 |
Molecular Structure: | |
Formula: | C9H18FeN3S6 |
Molecular Weight: | 416.505 |
Synonyms: | Carbamodithioic acid, dimethyl-, ironcomplex;Aafertis;Dimethyldithiocarbamic acid iron(3+)salt;Ferric N,N-dimethyldithiocarbamate;Irondimethyldithiocarbamate;Iron tris(dimethyldithiocarbamate);Liromate;Stauffer ferbam;Trimanzone;Tris(N,N-dimethyldithiocarbamato)iron;Tris(dimethyldithiocarbamato)iron; |
EINECS: | 238-484-2 |
Density: | 0.21[at 20℃] |
Melting Point: | 180 °C (dec.) |
Boiling Point: | 129.4 °C at 760 mmHg |
Flash Point: | 32 °C |
Solubility: | 130 mg l-1 (room temperature) |
Appearance: | odourless black solid |
Hazard Symbols: | Xi; N |
Risk Codes: | 36/37/38-50/53 |
Safety: | 26-36/37/39-61-60 |
Transport Information: | UN 3077 9/PG 3 |
PSA: | 181.89000 |
LogP: | 3.08870 |
sodium dimethyldithiocarbamate
tris(N,N-dimethyldithiocarbamato)iron(III)
Conditions | Yield |
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In chloroform; acetone mixing of Fe-complex (in CHCl3) with excess of Na2S2CNEt2 (in acetone); concn. (vac.), crystn. on EtOH addn., filtration, washing (EtOH); |
Conditions | Yield |
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In water iron(III) salt;; |
sodium dimethyldithiocarbamate
tris(N,N-dimethyldithiocarbamato)iron(III)
Conditions | Yield |
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In acetone addn. of excess NaS2CNMe2 to Fe-complex, stirring (room temp., 30 min); concn. (vac.), addn. of EtOH, concn. (vac., crystn.), filtration, washing (EtOH, acetone); elem. anal.; |
iron(II)
sodium dimethyldithiocarbamate
tris(N,N-dimethyldithiocarbamato)iron(III)
Conditions | Yield |
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In water iron(II) salt;; |
sodium dimethyldithiocarbamate
tris(N,N-dimethyldithiocarbamato)iron(III)
Conditions | Yield |
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In chloroform; acetone addn. of Fe-complex (in CHCl3) to excess of Na2S2CNMe2 (in acetone); pptn. on concn. (vac.), filtration; |
methylmercury(II) chloride
tris(N,N-dimethyldithiocarbamato)iron(III)
Conditions | Yield |
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In dichloromethane room temp., 10 min (pptn.); collection, washing (CH2Cl2), drying (vac., 100°C, several days); | 99% |
In benzene room temp., 10 min (pptn.); collection, washing (C6H6), drying (vac., 100°C, several days); elem. anal.; | 99% |
tris(N,N-dimethyldithiocarbamato)iron(III)
ethylmercury(II) chloride
Conditions | Yield |
---|---|
In benzene room temp., 10 min (pptn.); collection, washing (C6H6), drying (vac., 100°C, several days); | 99% |
In dichloromethane room temp., 10 min (pptn.); collection, washing (CH2Cl2), drying (vac., 100°C, several days); | 99% |
tris(N,N-dimethyldithiocarbamato)iron(III)
Conditions | Yield |
---|---|
With oxalic acid In methanol; benzene Kinetics; kinetic runs at 30°C in MeOH-C6H6, at least 10-fold excess of oxalic acid over the complex; not isolated; measuring absorbance at 348 nm; |
tris(N,N-dimethyldithiocarbamato)iron(III)
sodium diethyldithiocarbamate trihydrate
Conditions | Yield |
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In acetone addn. of excess NaS2CNEt2 to Fe-complex; concn. (vac.), addn. of EtOH (pptn.), filtration, washing (EtOH), drying (70°C); |
tris(N,N-dimethyldithiocarbamato)iron(III)
Conditions | Yield |
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addn. of diethyl ether;; elem. anal.;; |
IARC Cancer Review: Group 3 IMEMDT IARC Monographs on the Evaluation of Carcinogenic Risk of Chemicals to Man . 7 (1987),p. 56.(World Health Organization, Internation Agency for Research on Cancer,Lyon, France.: ) (Single copies can be ordered from WHO Publications Centre U.S.A., 49 Sheridan Avenue, Albany, NY 12210) ; Animal Inadequate Evidence IMEMDT IARC Monographs on the Evaluation of Carcinogenic Risk of Chemicals to Man . 12 (1976),p. 121.(World Health Organization, Internation Agency for Research on Cancer,Lyon, France.: ) (Single copies can be ordered from WHO Publications Centre U.S.A., 49 Sheridan Avenue, Albany, NY 12210) . Reported in EPA TSCA Inventory. EPA Genetic Toxicology Program.
OSHA PEL: TWA Total Dust: 10 mg/m3; Respirable Fraction: 5 mg/m3
ACGIH TLV: TWA 10 mg/m3; Not Classifiable as a Human Carcinogen
DFG MAK: 15 mg/m3
The Ferbam with CAS registry number of 14484-64-1 is also called Tris(dimethyldithiocarbamato)iron. The IUPAC name is N,N-dimethylcarbamodithioate; iron(3+). Its EINECS registry number is 238-484-2. In addition, the molecular formula is C9H18FeN3S6 and the molecular weight is 416.49. It is a kind of odourless black solid and belongs to the classes of Organometallics; Classes of Metal Compounds; Fe (Iron) Compounds; Transition Metal Compounds.
Physical properties about Ferbam are: (1)ACD/LogP: 0.75; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -1.06; (4)ACD/LogD (pH 7.4): -2.68; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1; (8)ACD/KOC (pH 7.4): 1; (9)#H bond acceptors: 1; (10)Polar Surface Area: 74.13 Å2; (11)Flash Point: 32 °C; (12)Enthalpy of Vaporization: 36.7 kJ/mol; (13)Boiling Point: 129.4 °C at 760 mmHg; (14)Vapour Pressure: 10.2 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. And it is very toxic to aquatic organisms. It may cause long-term adverse effects in the aquatic environment. During using it, wear suitable protective clothing, gloves and eye/face protection. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. This material and its container must be disposed of as hazardous waste. What's more, you should avoid release to the environment. And you can refer to special instructions/safety data sheets.
You can still convert the following datas into molecular structure:
(1)SMILES: [Fe+3].S=C([S-])N(C)C.[S-]C(=S)N(C)C.[S-]C(=S)N(C)C
(2)InChI: InChI=1/3C3H7NS2.Fe/c3*1-4(2)3(5)6;/h3*1-2H3,(H,5,6);/q;;;+3/p-3
(3)InChIKey: WHDGWKAJBYRJJL-DFZHHIFOAH
The toxicity data is as follows:
Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
---|---|---|---|---|---|
guinea pig | LDLo | intraperitoneal | 2300mg/kg (2300mg/kg) | Journal of the American Pharmaceutical Association, Scientific Edition. Vol. 41, Pg. 662, 1952. | |
guinea pig | LDLo | oral | 2gm/kg (2000mg/kg) | Journal of the American Pharmaceutical Association, Scientific Edition. Vol. 41, Pg. 662, 1952. | |
mouse | LD50 | intraperitoneal | 3gm/kg (3000mg/kg) | Journal of the American Pharmaceutical Association, Scientific Edition. Vol. 41, Pg. 662, 1952. | |
mouse | LD50 | oral | 3400mg/kg (3400mg/kg) | BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY) BEHAVIORAL: EXCITEMENT BEHAVIORAL: ATAXIA | Journal of Toxicology and Environmental Health. Vol. 4, Pg. 93, 1978. |
rabbit | LDLo | intraperitoneal | 1500mg/kg (1500mg/kg) | Journal of the American Pharmaceutical Association, Scientific Edition. Vol. 41, Pg. 662, 1952. | |
rabbit | LDLo | oral | 3gm/kg (3000mg/kg) | Journal of the American Pharmaceutical Association, Scientific Edition. Vol. 41, Pg. 662, 1952. | |
rat | LD50 | intraperitoneal | 2700mg/kg (2700mg/kg) | Journal of the American Pharmaceutical Association, Scientific Edition. Vol. 41, Pg. 662, 1952. | |
rat | LD50 | oral | 1130mg/kg (1130mg/kg) | Farmakologiya i Toksikologiya Vol. 32, Pg. 356, 1969. |