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CAS No.: | 24621-70-3 |
---|---|
Name: | 1H-INDOL-2-YLMETHANOL |
Article Data: | 2 |
Molecular Structure: | |
Formula: | C9H9NO |
Molecular Weight: | 147.177 |
Synonyms: | Indole-2-methanol(6CI,7CI,8CI);1H-Indol-2-ylmethanol;2-(Hydroxymethyl)indole;NSC 165230; |
Density: | 1.272 g/cm3 |
Melting Point: | 72-78 °C |
Boiling Point: | 360.6 °C at 760 mmHg |
Flash Point: | 171.9 °C |
Hazard Symbols: | Xi |
Risk Codes: | 41 |
Safety: | 26 |
PSA: | 36.02000 |
LogP: | 1.66020 |
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The 1H-Indole-2-methanol, with the CAS registry number 24621-70-3, is also known as NSC165230. It belongs to the product category of Heterocyclic Compounds. This chemical's molecular formula is C9H9NO and molecular weight is 147.17386. Its IUPAC name is called 1H-indol-2-ylmethanol.
Physical properties of 1H-Indole-2-methanol: (1)ACD/LogP: 0.96; (2)ACD/LogD (pH 5.5): 0.96; (3)ACD/LogD (pH 7.4): 0.96; (4)ACD/BCF (pH 5.5): 3.15; (5)ACD/BCF (pH 7.4): 3.15; (6)ACD/KOC (pH 5.5): 79.17; (7)ACD/KOC (pH 7.4): 79.17; (8)#H bond acceptors: 2; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 2; (11)Index of Refraction: 1.705; (12)Molar Refractivity: 44.97 cm3; (13)Molar Volume: 115.6 cm3; (14)Surface Tension: 61.7 dyne/cm; (15)Density: 1.272 g/cm3; (16)Flash Point: 171.9 °C; (17)Enthalpy of Vaporization: 63.98 kJ/mol; (18)Boiling Point: 360.6 °C at 760 mmHg; (19)Vapour Pressure: 7.89E-06 mmHg at 25°C.
When you are using this chemical, please be cautious about it as the following:
This chemical may cause inflammation to the skin or other mucous membranes. There will be a risk of serious damage to eyes. In case of contact with eyes, you should rinse immediately with plenty of water and seek medical advice.
You can still convert the following datas into molecular structure:
(1)Canonical SMILES: C1=CC=C2C(=C1)C=C(N2)CO
(2)InChI: InChI=1S/C9H9NO/c11-6-8-5-7-3-1-2-4-9(7)10-8/h1-5,10-11H,6H2
(3)InChIKey: XEEANGGQJOWRTG-UHFFFAOYSA-N