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2454-39-9

Basic Information
CAS No.: 2454-39-9
Name: 2-AMINO-THIOBENZAMIDE
Article Data: 21
Molecular Structure:
Molecular Structure of 2454-39-9 (2-AMINO-THIOBENZAMIDE)
Formula: C7H8N2S
Molecular Weight: 152.22
Synonyms: Benzamide,o-aminothio- (7CI,8CI);2-Aminobenzenethioamide;2-Aminobenzothioamide;2-Aminothiobenzamide;Thioanthranilamide;o-Aminothiobenzamide;
Density: 1.286 g/cm3
Melting Point: 120 °C
Boiling Point: 318.8 °C at 760mmHg
Flash Point: 146.6 °C
Solubility: Slightly soluble in water.
Appearance: Light yellow to yellow crystalline powder
Hazard Symbols: Xn
Risk Codes: 36/37/38
Safety: 26-36/37/39
PSA: 84.13000
LogP: 2.18450
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  • Benzenecarbothioamide,2-amino-

  • Casno:

    2454-39-9

    Benzenecarbothioamide,2-amino-

    Min.Order: 0

    FOB Price:  USD $ 0.0-0.0

    Benzenecarbothioamide,2-amino- Storage:keep in dry and cool condition Package:25kg or according to cutomer's demand Application:Chemical research/pharma intermediate Transportation:By Sea,by Air,By courier like DHL or Fedx. Port:Shanghai/Shenzhen

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  • 2-AMINO-THIOBENZAMIDE

  • Casno:

    2454-39-9

    2-AMINO-THIOBENZAMIDE

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    FOB Price:  USD $ 0.0-0.0

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    Jiaxing Isen Chemical Co Ltd is a high-tech pharmaceutical and chemical company, dedicated to pharmaceutical raw materials, intermediates research and product development . Dependi

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  • 2-Aminothiobenzamide

  • Casno:

    2454-39-9

    2-Aminothiobenzamide

    Min.Order: 0

    FOB Price:  USD $ 0.0-0.0

    Good Price, prompt shipment Application:Used in organic synthesis; Catalytic agent; Petrochemical additive;

    Skyrun Industrial Co.Limited (CSR Ind), established in 2003, a state-controlled company(By Skyrun Corp. & High Hope) in China, specializing in developing, producing and handing ra

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  • 2-Amino-thiobenzamide

  • Casno:

    2454-39-9

    2-Amino-thiobenzamide

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    FOB Price:  USD $ 0.0-0.0

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  • Benzenecarbothioamide,2-amino-

  • Casno:

    2454-39-9

    Benzenecarbothioamide,2-amino-

    Min.Order: 0

    FOB Price:  USD $ 0.0-0.0

    Manufacturer,strong R&D,professional team Storage:Store in a cool, dry place. Store in a tightly closed container. Package:according to your requirement Application:ZhiShang Chemical is owned by ZhiShang Group, is a professional new-type chemicals en

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Specification

The 2-Aminothiobenzamide, with the CAS registry number 2454-39-9, is also known as 2-Aminobenzene-1-carbothioamide. This chemical's molecular formula is C7H8N2S and molecular weight is 152.22. Its IUPAC name and systematic name are the same which is called 2-aminobenzenecarbothioamide. This chemical is light yellow to yellow crystalline powder.

Physical properties of 2-Aminothiobenzamide: (1)ACD/LogP: 0.99; (2)ACD/LogD (pH 5.5): 0.99; (3)ACD/LogD (pH 7.4): 0.99; (4)ACD/BCF (pH 5.5): 3.32; (5)ACD/BCF (pH 7.4): 3.32; (6)ACD/KOC (pH 5.5): 82.08; (7)ACD/KOC (pH 7.4): 82.12; (8)#H bond acceptors: 2; (9)#H bond donors: 4; (10)#Freely Rotating Bonds: 2; (11)Index of Refraction: 1.719; (12)Molar Refractivity: 46.67 cm3; (13)Molar Volume: 118.2 cm3; (14)Surface Tension: 75.8 dyne/cm; (15)Density: 1.286 g/cm3; (16)Melting Poing: 120 °C; (17)Flash Point: 146.6 °C; (18)Enthalpy of Vaporization: 56.03 kJ/mol; (19)Boiling Point: 318.8 °C at 760 mmHg; (20)Vapour Pressure: 0.000353 mmHg at 25°C.

Preparation: this chemical can be prepared by 2-amino-benzonitrile. This reaction will need reagent alcohol, ammonia, hydrogen sulfide. The reaction temperature is 100 ℃.

Uses of 2-Aminothiobenzamide: it can be heated to produce 2-trifluoromethyl-3H-quinazoline-4-thione. This reaction will need reagent molecular sieves and solvent CHCl3 with reaction time of 2 hours. The yield is about 90%.

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. Whenever you will contact it, please wear suitable protective clothing, gloves and eye/face protection.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: C1=CC=C(C(=C1)C(=S)N)N
(2)InChI: InChI=1S/C7H8N2S/c8-6-4-2-1-3-5(6)7(9)10/h1-4H,8H2,(H2,9,10)
(3)InChIKey: HPZKAJRFABCGFF-UHFFFAOYSA-N