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2-Hydroxycarbazole-3-carboxanilide

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Name

2-Hydroxycarbazole-3-carboxanilide

EINECS 1312995-182-4
CAS No. 94212-15-4 Density 1.417 g/cm3
PSA 65.12000 LogP 4.35200
Solubility N/A Melting Point N/A
Formula C19H14N2O2 Boiling Point 490.4 °C at 760 mmHg
Molecular Weight 302.33 Flash Point 250.4 °C
Transport Information N/A Appearance N/A
Safety 26 Risk Codes 36/37/38
Molecular Structure Molecular Structure of 94212-15-4 (NAPHTHOL AS-BL) Hazard Symbols Xi
Synonyms

2-Hydroxy-N-phenyl-9H-carbazole-3-carboxamide; Naphthol AS-BL

 

2-Hydroxycarbazole-3-carboxanilide Specification

The 2-Hydroxycarbazole-3-carboxanilide, with the CAS registry number 94212-15-4, has the systematic name of 9H-carbazole-3-carboxamide, 2-hydroxy-N-phenyl-. It belongs to the following product categories: Cytochemistry Products; Hematology and Histology. And the molecular formula of the chemical is C19H14N2O2. What's more, it should be stored at 2-8°C.

The characteristics of 2-Hydroxycarbazole-3-carboxanilide are as followings: (1)ACD/LogP: 4.77; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 4.77; (4)ACD/LogD (pH 7.4): 4.74; (5)ACD/BCF (pH 5.5): 2489.06; (6)ACD/BCF (pH 7.4): 2302.18; (7)ACD/KOC (pH 5.5): 9383.05; (8)ACD/KOC (pH 7.4): 8678.57; (9)#H bond acceptors: 4; (10)#H bond donors: 3; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 65.12 Å2; (13)Index of Refraction: 1.819; (14)Molar Refractivity: 92.82 cm3; (15)Molar Volume: 213.2 cm3; (16)Polarizability: 36.8×10-24cm3; (17)Surface Tension: 75.7 dyne/cm; (18)Density: 1.417 g/cm3; (19)Flash Point: 250.4 °C; (20)Enthalpy of Vaporization: 78.57 kJ/mol; (21)Boiling Point: 490.4 °C at 760 mmHg; (22)Vapour Pressure: 3.05E-10 mmHg at 25°C. 

Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: c1ccc(cc1)NC(=O)c2cc3c4ccccc4[nH]c3cc2O
(2)InChI: InChI=1/C19H14N2O2/c22-18-11-17-14(13-8-4-5-9-16(13)21-17)10-15(18)19(23)20-12-6-2-1-3-7-12/h1-11,21-22H,(H,20,23)
(3)InChIKey: XDCTVFJNJVPBOF-UHFFFAOYAH

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