2-Thiophenemethanol,3-(1H-pyrrol-1-yl)- supplier

Name
[3-(1H-PYRROL-1-YL)-2-THIENYL]METHANOL
EINECS
CAS No. 107073-27-8
Article Data2
CAS DataBase
Density 1.25 g/cm³
Solubility
Melting Point 100 °C (sublm)(Press: 5 Torr)
Formula C₉H₉NOS
Boiling Point 344.1 °C at 760 mmHg
Molecular Weight 179.243
Flash Point 161.9 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 1-[2-(Hydroxymethyl)thien-3-yl]-1H-pyrrole;3-(Pyrrol-1-yl)thiophene-2-methanol;
PSA 53.40000
LogP 2.03110

2-Thiophenemethanol,3-(1H-pyrrol-1-yl)- Specification

The 2-Thiophenemethanol,3-(1H-pyrrol-1-yl)-, with the CAS registry number 107073-27-8, is also known as 1-[2-(Hydroxymethyl)thien-3-yl]-1H-pyrrole. This chemical's molecular formula is C₉H₉NOS and molecular weight is 179.24. What's more, its systematic name is [3-(1H-pyrrol-1-yl)thiophen-2-yl]methanol.

Physical properties of 2-Thiophenemethanol,3-(1H-pyrrol-1-yl)- are: (1)ACD/LogP: 1.57; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 2; (4)#H bond donors: 1; (5)#Freely Rotating Bonds: 3; (6)Polar Surface Area: 42.4 Å²; (7)Index of Refraction: 1.64; (8)Molar Refractivity: 51.54 cm³; (9)Molar Volume: 142.9 cm³; (10)Polarizability: 20.43×10^-24 cm³; (11)Surface Tension: 50.7 dyne/cm; (12)Density: 1.25 g/cm³; (13)Flash Point: 161.9 °C; (14)Enthalpy of Vaporization: 62.05 kJ/mol; (15)Boiling Point: 344.1 °C at 760 mmHg; (16)Vapour Pressure: 2.58E-05 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1)SMILES: OCc2sccc2n1cccc1
(2)InChI: InChI=1/C9H9NOS/c11-7-9-8(3-6-12-9)10-4-1-2-5-10/h1-6,11H,7H2
(3)InChIKey: SMSUHWYHSLZKHS-UHFFFAOYAU

Product Name

[3-(1H-PYRROL-1-YL)-2-THIENYL]METHANOL

2-Thiophenemethanol,3-(1H-pyrrol-1-yl)- Specification

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