CAS No.1551-27-5,2-N-PROPYLTHIOPHENE Suppliers,MSDS download

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Basic Information

Molecular Structure:
CAS No.:	1551-27-5
Name:	2-N-PROPYLTHIOPHENE
Article Data:	21

Formula:	C₇H₁₀S
Molecular Weight:	126.222
Synonyms:	2-Propylthiophene;2-n-Propylthiophene;NSC 82326;
EINECS:	216-288-8
Density:	0.984 g/cm³
Melting Point:	-51.23°C (estimate)
Boiling Point:	158.353 °C at 760 mmHg
Flash Point:	32.329 °C
Hazard Symbols:	Xi
Risk Codes:	36/37/38
Safety:	26-36
Transport Information:	UN 1993 3/PG 3
PSA:	28.24000
LogP:	2.70060

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Specification

The Thiophene, 2-propyl-, with CAS registry number 1551-27-5, belongs to the following product categories: (1)Building Blocks; (2)Heterocyclic Building Blocks; (3)Thiophenes. It has the systematic name of 2-propylthiophene. And the chemical formula of this chemical is C₇H₁₀S.

Physical properties of Thiophene, 2-propyl-: (1)ACD/LogP: 3.42; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.42; (4)ACD/LogD (pH 7.4): 3.42; (5)ACD/BCF (pH 5.5): 233.61; (6)ACD/BCF (pH 7.4): 233.61; (7)ACD/KOC (pH 5.5): 1725.75; (8)ACD/KOC (pH 7.4): 1725.75; (9)#H bond acceptors: 0; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 28.24 Å²; (13)Index of Refraction: 1.517; (14)Molar Refractivity: 38.81 cm³; (15)Molar Volume: 128.2 cm³; (16)Polarizability: 15.38×10^-24cm³; (17)Surface Tension: 32.7 dyne/cm; (18)Enthalpy of Vaporization: 37.88 kJ/mol; (19)Vapour Pressure: 3.41 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
The Thiophene, 2-propyl- irritates to eyes, respiratory system and skin. When use it, wear suitable protective clothing, gloves and eye/face protection. If 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: s1c(ccc1)CCC
(2)InChI: InChI=1/C7H10S/c1-2-4-7-5-3-6-8-7/h3,5-6H,2,4H2,1H3
(3)InChIKey: BTXIJTYYMLCUHI-UHFFFAOYAY
(4)Std. InChI: InChI=1S/C7H10S/c1-2-4-7-5-3-6-8-7/h3,5-6H,2,4H2,1H3
(5)Std. InChIKey: BTXIJTYYMLCUHI-UHFFFAOYSA-N