CAS No.128-04-1,Sodium dimethyldithiocarbamate Suppliers,MSDS download

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Basic Information

Molecular Structure:
CAS No.:	128-04-1
Name:	Sodium dimethyldithiocarbamate
Article Data:	17
Cas Database

Formula:	C₃H₇NNaS₂
Molecular Weight:	179.24
Synonyms:	(Dimethyldithiocarbamato)sodium;Dimethyldithiocarbamicacid sodium salt;N,N-Dimethyldithiocarbamic acid sodium salt;
EINECS:	204-876-7
Density:	1.17 g/cm³
Melting Point:	120-122 °C (dec.)(lit.)
Boiling Point:	129.4 °C at 760 mmHg
Flash Point:	32 °C
Solubility:	374g/L at 20℃
Appearance:	clear yellow liquid
Hazard Symbols:	Xn
Risk Codes:	22-36
Safety:	26-36
PSA:	60.63000
LogP:	1.03040

Synthetic route

: 75-15-0
carbon disulfide

: 506-59-2
N,N-dimethylammonium chloride

: 128-04-1
sodium dimethyldithiocarbamate

Conditions

Conditions	Yield
With sodium hydroxide In methanol for 3h; Ambient temperature;	100%

: 75-15-0
carbon disulfide

: 124-40-3
dimethyl amine

: 128-04-1
sodium dimethyldithiocarbamate

Conditions

Conditions	Yield
With sodium hydroxide at 25℃; Temperature;	99.85%
With sodium hydroxide In water at 20℃; for 1.5h; Cooling with ice-water bath;	59%
With sodium hydroxide In methanol other reagent;

: 137-26-8
Thiram

: 128-04-1
sodium dimethyldithiocarbamate

Conditions

Conditions	Yield
With sodium amalgam In tetrahydrofuran for 2h;

: 56-23-5
tetrachloromethane

: 127-19-5
N,N-dimethyl acetamide

CS2: CS2

: 128-04-1
sodium dimethyldithiocarbamate

Conditions

Conditions	Yield
With water

...Expand

: 56-23-5
tetrachloromethane

: 68-12-2, 33513-42-7
N,N-dimethyl-formamide

CS2: CS2

: 128-04-1
sodium dimethyldithiocarbamate

Conditions

Conditions	Yield
With water

...Expand

: 66310-10-9
N-benzyl-2,4,6-triphenylpyridinium tetrafluoroborate

: 128-04-1
sodium dimethyldithiocarbamate

: 7250-18-2
benzyl dimethyldithiocarbamate

Conditions

Conditions	Yield
In ethanol for 1h; Heating;	99%

: butyl <2>betylate perchlorate

: 128-04-1
sodium dimethyldithiocarbamate

: 70031-50-4
S-butyl N,N-dimethyldithiocarbamate

Conditions

Conditions	Yield
In water at 25℃; for 0.5h;	99%

: tris(isopropylthio)cyclopropenylium perchlorate

: 128-04-1
sodium dimethyldithiocarbamate

: Dimethyl-(3,4,5-tris-isopropylsulfanyl-thiophen-2-yl)-amine

Conditions

Conditions	Yield
In acetonitrile for 1h; Ambient temperature;	99%

: 58529-40-1
1,2-dichloro-tetramethyl-distannane

: 128-04-1
sodium dimethyldithiocarbamate

: (CH3)2Sn(SC(N(CH3)2)S)2Sn(CH3)2

Conditions

Conditions	Yield
In water to stirred soln. of tin compd. in degassed H2O was slowly added soln. of Na- (or NH4-) Me2NCSS (50-100% excess); formed ppt. was filtered off, washed with water, then with a little MeOH and dried in vac. at room temp.; recrystn. from CHCl3; elem. anal.;	99%

: 81097-48-5
N-tosyl-6-azabicyclo[3.1.0]hexane

: 128-04-1
sodium dimethyldithiocarbamate

: C15H22N2O2S3

Conditions

Conditions	Yield
In acetonitrile at 80℃; for 0.5h; stereoselective reaction;	99%

Raw Materials

124-40-3

137-26-8

56-23-5

68-12-2

127-19-5

75-15-0

506-59-2

Downstream Products

603-33-8

97-74-5

16913-62-5

34683-69-7

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Consensus Reports

Sodium dimethyldithiocarbamate(128-04-1) is reported in EPA TSCA Inventory.

Specification

The IUPAC name of this chemical is Sodium N,N-dimethyldithiocarbamate. With the CAS registry number 128-04-1 and EINECS registry number 204-876-7, it is also named as Dimethyldithiocarbamicacid sodium salt. In addition, the molecular formula is C₃H₇NNaS₂ and the molecular weight is 144.21. It is a kind of clear yellow solution and belongs to the classes of Pharmaceutical Intermediates; Aliphatics; Classes of Metal Compounds; Na (Sodium) Compounds (excluding simple sodium salts); Typical Metal Compounds. What's more, it can be used as intermediates in organic synthesis, accelerant of rubber, antiseptic and corrosion inhibitor.

Physical properties about this chemical 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)#Freely Rotating Bonds: 0; (11)Polar Surface Area: 74.13 Å²; (12)Flash Point: 32 °C; (13)Enthalpy of Vaporization: 36.7 kJ/mol; (14)Boiling Point: 129.4 °C at 760 mmHg; (15)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 harmful if swallowed and irritating to eyes. During using it, wear suitable protective clothing. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
(1)SMILES: [Na+].[S-]C(=S)N(C)C
(2)InChI: InChI=1/C3H7NS2.Na/c1-4(2)3(5)6;/h1-2H3,(H,5,6);/q;+1/p-1
(3)InChIKey: VMSRVIHUFHQIAL-REWHXWOFAU

The toxicity data is as follows:

Organism	Test Type	Route	Reported Dose (Normalized Dose)	Effect	Source
mouse	LD50	intraperitoneal	573mg/kg (573mg/kg)		Yakugaku Zasshi. Journal of Pharmacy. Vol. 94, Pg. 1419, 1974.
mouse	LD50	oral	1500mg/kg (1500mg/kg)	BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY) BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD BEHAVIORAL: CHANGES IN MOTOR ACTIVITY (SPECIFIC ASSAY)	Farmakologiya i Toksikologiya Vol. 28, Pg. 230, 1965.
rabbit	LD50	oral	300mg/kg (300mg/kg)		Toksikologicheskii Vestnik. Vol. (3), Pg. 34, 2000.
rat	LD	skin	> 5gm/kg (5000mg/kg)		Toksikologicheskii Vestnik. Vol. (3), Pg. 34, 2000.
rat	LD50	intraperitoneal	1gm/kg (1000mg/kg)		Pharmazie. Vol. 27, Pg. 139, 1972.
rat	LD50	oral	1gm/kg (1000mg/kg)		Pesticide Chemicals Official Compendium, Association of the American Pesticide Control Officials, Inc., 1966. Vol. -, Pg. 1029, 1966.