1H-Pyrrol-3-ol,5-phenyl- supplier

Name
3-HYDROXY-5-PHENYLPYRROLE
EINECS
CAS No. 100750-40-1
Density 1.21 g/cm³
Solubility
Melting Point 304-307 °C
Formula C₁₀H₉NO
Boiling Point 392.3 °C at 760 mmHg
Molecular Weight 159.18
Flash Point 191.1 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 3-Hydroxy-5-phenylpyrrole;5-Phenyl-3-hydroxypyrrole;
PSA 36.02000
LogP 2.38730

1H-Pyrrol-3-ol,5-phenyl- Specification

The 1H-Pyrrol-3-ol,5-phenyl- is an organic compound with the formula C₁₀H₉NO. The systematic name of this chemical is 5-phenyl-1H-pyrrol-3-ol. With the CAS registry number 100750-40-1, it is also named as 3-Hydroxy-5-phenylpyrrole. The product's categories are Nucleotides and Nucleosides; Diagnostic.

Physical properties about 1H-Pyrrol-3-ol,5-phenyl- are: (1)ACD/LogP: 2.01; (2)ACD/LogD (pH 5.5): 1.96; (3)ACD/LogD (pH 7.4): 2.01; (4)ACD/BCF (pH 5.5): 17.84; (5)ACD/BCF (pH 7.4): 19.89; (6)ACD/KOC (pH 5.5): 265.09; (7)ACD/KOC (pH 7.4): 295.52; (8)#H bond acceptors: 2; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 2; (11)Polar Surface Area: 14.16 Å²; (12)Index of Refraction: 1.636; (13)Molar Refractivity: 47.15 cm³; (14)Molar Volume: 131.4 cm³; (15)Polarizability: 18.69×10^-24cm³; (16)Surface Tension: 53.3 dyne/cm; (17)Density: 1.21 g/cm³; (18)Flash Point: 191.1 °C; (19)Enthalpy of Vaporization: 66.71 kJ/mol; (20)Boiling Point: 392.3 °C at 760 mmHg; (21)Vapour Pressure: 1.02E-06 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Oc2cc(c1ccccc1)nc2
(2)InChI: InChI=1/C10H9NO/c12-9-6-10(11-7-9)8-4-2-1-3-5-8/h1-7,11-12H
(3)InChIKey: BMJFHUYFKGXBCA-UHFFFAOYAQ
(4)Std. InChI: InChI=1S/C10H9NO/c12-9-6-10(11-7-9)8-4-2-1-3-5-8/h1-7,11-12H
(5)Std. InChIKey: BMJFHUYFKGXBCA-UHFFFAOYSA-N

Product Name

3-HYDROXY-5-PHENYLPYRROLE

1H-Pyrrol-3-ol,5-phenyl- Specification

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