6-Benzyloxy-1H-indole-3-carboxylic acid supplier

Name
6-Benzyloxy-1H-indole-3-carboxylic acid
EINECS
CAS No. 24370-74-9
Density 1.342 g/cm³
Solubility
Melting Point
Formula C₁₆H₁₃NO₃
Boiling Point 531.136 °C at 760 mmHg
Molecular Weight 267.28
Flash Point 275.021 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 6-Benzyloxy-1H-indole-3-carboxylicacid;6-benzyloxy-indole-3-carboxylic acid;6-Benzyloxy-indol-3-carbonsaeure;6-Benzyloxy-indol-carbonsaeure-(3);
PSA 62.32000
LogP 3.44510

6-Benzyloxy-1H-indole-3-carboxylic acid Specification

The 6-Benzyloxy-1H-indole-3-carboxylic acid is an organic compound with the formula C₁₆H₁₃NO₃. With the CAS registry number 24370-74-9, the systematic name of this chemical is 6-benzyloxy-1H-indole-3-carboxylic acid.

Physical properties about 6-Benzyloxy-1H-indole-3-carboxylic acid are: (1)ACD/LogP: 3.39; (2)ACD/LogD (pH 5.5): 1.935; (3)ACD/LogD (pH 7.4): 0.45; (4)ACD/BCF (pH 5.5): 7.81; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 58.684; (7)ACD/KOC (pH 7.4): 1.92; (8)#H bond acceptors: 4; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 4; (11)Polar Surface Area: 62.32 Å²; (12)Index of Refraction: 1.696; (13)Molar Refractivity: 76.625 cm³; (14)Molar Volume: 199.105 cm³; (15)Polarizability: 30.376×10^-24cm³; (16)Surface Tension: 63.321 dyne/cm; (17)Density: 1.342 g/cm³; (18)Flash Point: 275.021 °C; (19)Enthalpy of Vaporization: 84.901 kJ/mol; (20)Boiling Point: 531.136 °C at 760 mmHg.

You can still convert the following datas into molecular structure:
(1)SMILES: c1ccc(cc1)COc2ccc3c(c2)[nH]cc3C(=O)O
(2)InChI: InChI=1/C16H13NO3/c18-16(19)14-9-17-15-8-12(6-7-13(14)15)20-10-11-4-2-1-3-5-11/h1-9,17H,10H2,(H,18,19)
(3)InChIKey: BZTJFYMDTZJVNP-UHFFFAOYAV
(4)Std. InChI: InChI=1S/C16H13NO3/c18-16(19)14-9-17-15-8-12(6-7-13(14)15)20-10-11-4-2-1-3-5-11/h1-9,17H,10H2,(H,18,19)
(5)Std. InChIKey: BZTJFYMDTZJVNP-UHFFFAOYSA-N

Product Name

6-Benzyloxy-1H-indole-3-carboxylic acid

6-Benzyloxy-1H-indole-3-carboxylic acid Specification

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