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141-98-0

Basic Information
CAS No.: 141-98-0
Name: O-isopropyl ethylthiocarbamate
Article Data: 10
Molecular Structure:
Molecular Structure of 141-98-0 (O-isopropyl ethylthiocarbamate)
Formula: C6H13NOS
Molecular Weight: 147.241
Synonyms: Carbamicacid, ethylthio-, O-isopropyl ester (6CI,8CI);Carbamothioic acid, ethyl-,O-(1-methylethyl) ester (9CI);Ethylthiocarbamic acid, O-isopropyl ester;Minerec 2030;O-Isopropyl N-ethylthiocarbamate;Z 200 (flotationagent);
EINECS: 205-517-7
Density: 0.994 g/cm3
Boiling Point: 165.317 °C at 760 mmHg
Flash Point: 53.782 °C
Solubility: 114.4-2650mg/L at 25℃
PSA: 53.35000
LogP: 1.69670
Synthetic route
51698-64-7

2-propylcarbonothioylthiomethylbenzene

3926-62-3

sodium monochloroacetic acid

75-04-7

ethylamine

A

119812-11-2

sodium benzylsulfanylacetate

B

141-98-0

O-isopropyl-N-ethylthionocarbamate

Conditions
ConditionsYield
Stage #1: 2-propylcarbonothioylthiomethylbenzene; ethylamine In water at 70℃; for 1h;
Stage #2: sodium monochloroacetic acid In water at 70℃; for 2h;
A n/a
B 97%
140-93-2

sodium isopropylxanthate

75-04-7

ethylamine

141-98-0

O-isopropyl-N-ethylthionocarbamate

Conditions
ConditionsYield
Stage #1: sodium isopropylxanthate With sodium carbonate; chloroacetic acid In water at 60℃; for 2h; pH=Ca. 8;
Stage #2: ethylamine In water at 20 - 70℃; for 1h;
94%
With palladium supported titanium-hexagonal mesoporous silica-10 In water at 75℃; for 10h; Reagent/catalyst; Solvent;93%

nickel(II) sulphate

140-93-2

sodium isopropylxanthate

75-04-7

ethylamine

141-98-0

O-isopropyl-N-ethylthionocarbamate

Conditions
ConditionsYield
In water69%
105-65-7

diisopropyl xanthogen disulfide

75-04-7

ethylamine

A

C2H7N*C4H8OS2

B

141-98-0

O-isopropyl-N-ethylthionocarbamate

Conditions
ConditionsYield
With sodium hypochlorite In water
51698-64-7

2-propylcarbonothioylthiomethylbenzene

75-04-7

ethylamine

A

141-98-0

O-isopropyl-N-ethylthionocarbamate

B

100-53-8

phenylmethanethiol

Conditions
ConditionsYield
at 70℃; for 2h;
In water at 70℃; for 2h;

O-isopropyl-S-hydroxyethylxanthate

75-04-7

ethylamine

A

141-98-0

O-isopropyl-N-ethylthionocarbamate

B

60-24-2

2-hydroxyethanethiol

Conditions
ConditionsYield
In water at 70℃; for 1h;
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  • Carbamothioic acid,N-ethyl-, O-(1-methylethyl) ester

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    141-98-0

    Carbamothioic acid,N-ethyl-, O-(1-methylethyl) ester

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  • O-isopropyl ethylthiocarbamate

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    141-98-0

    O-isopropyl ethylthiocarbamate

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  • O-isopropyl ethylthiocarbamate

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    141-98-0

    O-isopropyl ethylthiocarbamate

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    J&H CHEM is one of China's leading providers of integrated fine chemical services including offering, research and development, Custom manufacturing business, as well as other Value-added customer services, for diversified range products of chemicals

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  • O-isopropyl ethylthiocarbamate

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    141-98-0

    O-isopropyl ethylthiocarbamate

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  • O-isopropyl ethylthiocarbamate

  • Casno:

    141-98-0

    O-isopropyl ethylthiocarbamate

    Min.Order: 0

    FOB Price:  USD $ 0.0-0.0

    1,we produce and sell good chemicals around the world.2,our success rate is about 95%. this means, if customer order is accepted, the probability that the customer will obtain the ordered substances, is 95%.3,our staff consists of highly qualified in

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  • Carbamothioic acid,N-ethyl-, O-(1-methylethyl) ester

  • Casno:

    141-98-0

    Carbamothioic acid,N-ethyl-, O-(1-methylethyl) ester

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  • O-isopropyl ethylthiocarbamate

  • Casno:

    141-98-0

    O-isopropyl ethylthiocarbamate

    Min.Order: 0

    FOB Price:  USD $ 0.0-0.0

    We product this chemical more than 10 years . We are very experience to export it to many countries, Our superior & stable quality , competitive price gain warm reception from our customers. Application:intermediate

    HANGZHOU TIANYE CHEMICALS Co.LTD , Located in Eastern Science and Innovation Park Hangzhou . We are a high-tech enterprise specialized in technical research and development, produc

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Specification

The O-Isopropyl ethylthiocarbamate with cas registry number of 141-98-0, whose systematic name is O-(1-methylethyl) ethylthiocarbamate. And its IUPAC name is O-propan-2-yl N-ethylcarbamothioate. Besides this, it is also named carbamothioic acid, N-ethyl-, O-(1-methylethyl) ester.

 Physical properties about this chemical are: (1)ACD/LogP: 1.74; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.74; (4)ACD/LogD (pH 7.4): 1.74; (5)ACD/BCF (pH 5.5): 12.27; (6)ACD/BCF (pH 7.4): 12.27; (7)ACD/KOC (pH 5.5): 209.44; (8)ACD/KOC (pH 7.4): 209.45; (9)#H bond acceptors: 2; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 44.56 Å2; (13)Index of Refraction: 1.484; (14)Molar Refractivity: 42.43 cm3; (15)Molar Volume: 148.1 cm3; (16)Polarizability: 16.82×10-24cm3; (17)Surface Tension: 35.8 dyne/cm; (18)Enthalpy of Vaporization: 40.18 kJ/mol; (19)Vapour Pressure: 1.88 mmHg at 25°C.

You can still convert the following datas into molecular structure: 
(1)SMILES:S=C(OC(C)C)NCC;
(2)InChI:InChI=1/C6H13NOS/c1-4-7-6(9)8-5(2)3/h5H,4H2,1-3H3,(H,7,9);
(3)InChIKey:KIACEOHPIRTHMI-UHFFFAOYAC;
(4)Std. InChI:InChI=1S/C6H13NOS/c1-4-7-6(9)8-5(2)3/h5H,4H2,1-3H3,(H,7,9);
(5)Std. InChIKey:KIACEOHPIRTHMI-UHFFFAOYSA-N