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17626-75-4

Basic Information
CAS No.: 17626-75-4
Name: 2-N-PROPYLTHIAZOLE
Molecular Structure:
Molecular Structure of 17626-75-4 (2-N-PROPYLTHIAZOLE)
Formula: C6H9NS
Molecular Weight: 127.21
Synonyms: 2-Propylthiazole;2-n-Propylthiazole;2-propyl-1,3-thiazole;
EINECS: 241-606-7
Density: 1.047 g/cm3
Boiling Point: 168.3 °C at 760 mmHg
Flash Point: 53.1 °C
Appearance: clear colorless to yellow liquid
Hazard Symbols: HarmfulXn; IrritantXi
Risk Codes: 22-10
Safety: 36/37/39-26-23-16
Transport Information: UN1993
PSA: 41.13000
LogP: 2.09560
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  • Casno:

    17626-75-4

    2-n-Propylthiazole

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  • Casno:

    17626-75-4

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  • Casno:

    17626-75-4

    2-N-PROPYLTHIAZOLE

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  • 2-Propyl thiazole

  • Casno:

    17626-75-4

    2-Propyl thiazole

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  • 2-n-Propylthiazole

  • Casno:

    17626-75-4

    2-n-Propylthiazole

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  • 2-Propyl thiazole

  • Casno:

    17626-75-4

    2-Propyl thiazole

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Specification

The 2-propyl thiazole, with the CAS registry number 17626-75-4 and EINECS registry number 241-606-7, has the systematic name of 2-propyl-1,3-thiazole. It is a kind of clear colorless to yellow liquid, and belongs to the following product categories: Thiazoles, Isothiazoles & Benzothiazoles. And the molecular formula of the chemical is C6H9NS.

The characteristics of 2-propyl thiazole are as followings: (1)ACD/LogP: 2.16; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.16; (4)ACD/LogD (pH 7.4): 2.16; (5)ACD/BCF (pH 5.5): 25.84; (6)ACD/BCF (pH 7.4): 26; (7)ACD/KOC (pH 5.5): 356.21; (8)ACD/KOC (pH 7.4): 358.42; (9)#H bond acceptors: 1; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 41.13 Å2; (13)Index of Refraction: 1.519; (14)Molar Refractivity: 36.91 cm3; (15)Molar Volume: 121.4 cm3; (16)Polarizability: 14.63×10-24cm3; (17)Surface Tension: 37.6 dyne/cm; (18)Density: 1.047 g/cm3; (19)Flash Point: 53.1 °C; (20)Enthalpy of Vaporization: 38.81 kJ/mol; (21)Boiling Point: 168.3 °C at 760 mmHg; (22)Vapour Pressure: 2.16 mmHg at 25°C. 

You should be cautious while dealing with this chemical. It is a kind of flammable chemical which is harmful if swallowed. Therefore, you had better take the following instructions: Keep away from sources of ignition - No smoking; Do not breathe gas/fumes/vapor/spray (appropriate wording to be specified by the manufacturer); Wear suitable protective clothing, gloves and eye/face protection, and if in case of contacting with eyes, rinse immediately with plenty of water and seek medical advice.

Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: n1ccsc1CCC
(2)InChI: InChI=1/C6H9NS/c1-2-3-6-7-4-5-8-6/h4-5H,2-3H2,1H3
(3)InChIKey: CMOIEFFAOUQJPS-UHFFFAOYAD