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14484-64-1

Basic Information
CAS No.: 14484-64-1
Name: FERBAM
Article Data: 9
Molecular Structure:
Molecular Structure of 14484-64-1 (FERBAM)
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: IrritantXi; DangerousN
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
Synthetic route

Fe(diethyldithiocarbamate)2SCN

128-04-1

sodium dimethyldithiocarbamate

14484-64-1

tris(N,N-dimethyldithiocarbamato)iron(III)

Conditions
ConditionsYield
In chloroform; acetone mixing of Fe-complex (in CHCl3) with excess of Na2S2CNEt2 (in acetone); concn. (vac.), crystn. on EtOH addn., filtration, washing (EtOH);

iron(III)

128-04-1

sodium dimethyldithiocarbamate

14484-64-1

tris(N,N-dimethyldithiocarbamato)iron(III)

Conditions
ConditionsYield
In water iron(III) salt;;

tris(diethyldithiocarbamato)iron(III)

128-04-1

sodium dimethyldithiocarbamate

14484-64-1

tris(N,N-dimethyldithiocarbamato)iron(III)

Conditions
ConditionsYield
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.;
7439-89-6

iron(II)

128-04-1

sodium dimethyldithiocarbamate

14484-64-1

tris(N,N-dimethyldithiocarbamato)iron(III)

Conditions
ConditionsYield
In water iron(II) salt;;

chlorobis(N,N-diethyldithiocarbamato)iron(III)

128-04-1

sodium dimethyldithiocarbamate

14484-64-1

tris(N,N-dimethyldithiocarbamato)iron(III)

Conditions
ConditionsYield
In chloroform; acetone addn. of Fe-complex (in CHCl3) to excess of Na2S2CNMe2 (in acetone); pptn. on concn. (vac.), filtration;
115-09-3

methylmercury(II) chloride

14484-64-1

tris(N,N-dimethyldithiocarbamato)iron(III)

chlorobis(N,N-dimethyldithiocarbamato)iron(III)

Conditions
ConditionsYield
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%
14484-64-1

tris(N,N-dimethyldithiocarbamato)iron(III)

107-27-7

ethylmercury(II) chloride

chlorobis(N,N-dimethyldithiocarbamato)iron(III)

Conditions
ConditionsYield
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%
14484-64-1

tris(N,N-dimethyldithiocarbamato)iron(III)

tris(dimethyldithiocarbamato)iron(I2I)

Conditions
ConditionsYield
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;
14484-64-1

tris(N,N-dimethyldithiocarbamato)iron(III)

20624-25-3

sodium diethyldithiocarbamate trihydrate

tris(diethyldithiocarbamato)iron(III)

Conditions
ConditionsYield
In acetone addn. of excess NaS2CNEt2 to Fe-complex; concn. (vac.), addn. of EtOH (pptn.), filtration, washing (EtOH), drying (70°C);

Cu(4+)*3(S2CN(CH3)2)(1-)*BF4(1-)={Cu(S2CN(CH3)2)3}BF4

14484-64-1

tris(N,N-dimethyldithiocarbamato)iron(III)

A

Fe(4+)*3(S2CN(CH3)2)(1-)*BF4(1-)={Fe(S2CN(CH3)2)3}BF4

B

bis(dimethyldithiocarbamato)copper(II)

Conditions
ConditionsYield
addn. of diethyl ether;; elem. anal.;;
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  • 14484-64-1 FERBAMCAS NO.: 14484-64-1

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  • 14484-64-1           C9H18FeN3S6           FERBAM

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Consensus Reports

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.

Standards and Recommendations

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

Specification

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.