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5,6,7,8-Tetrahydroacridine-9-carboxamide

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Name

5,6,7,8-Tetrahydroacridine-9-carboxamide

EINECS N/A
CAS No. 42878-53-5 Density 1.241 g/cm3
PSA 55.98000 LogP 2.91280
Solubility N/A Melting Point >300 °C(Solv: methanol (67-56-1))
Formula C14H14N2O Boiling Point 409.7 °C at 760 mmHg
Molecular Weight 226.278 Flash Point 201.6 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 42878-53-5 (1,2,3,4-TETRAHYDRO-ACRIDINE-9-CARBOXYLIC ACID AMIDE) Hazard Symbols N/A
Synonyms

ZINC02565440;

Article Data 5

5,6,7,8-Tetrahydroacridine-9-carboxamide Specification

The 5,6,7,8-Tetrahydroacridine-9-carboxamide, with the CAS registry number 42878-53-5, is also known as ZINC02565440. This chemical's molecular formula is C14H14N2O and molecular weight is 226.110613. Its IUPAC name is called 1,2,3,4-tetrahydroacridine-9-carboxamide.

Physical properties of 5,6,7,8-Tetrahydroacridine-9-carboxamide: (1)ACD/LogP: 2.29; (2)ACD/LogD (pH 5.5): 2.27; (3)ACD/LogD (pH 7.4): 2.29; (4)ACD/BCF (pH 5.5): 31.07; (5)ACD/BCF (pH 7.4): 32.47; (6)ACD/KOC (pH 5.5): 402.03; (7)ACD/KOC (pH 7.4): 420.24; (8)#H bond acceptors: 3; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 1; (11)Index of Refraction: 1.667; (12)Molar Refractivity: 67.9 cm3; (13)Molar Volume: 182.3 cm3; (14)Surface Tension: 59.3 dyne/cm; (15)Density: 1.241 g/cm3; (16)Flash Point: 201.6 °C; (17)Enthalpy of Vaporization: 66.19 kJ/mol; (18)Boiling Point: 409.7 °C at 760 mmHg; (19)Vapour Pressure: 6.38E-07 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: C1CCC2=NC3=CC=CC=C3C(=C2C1)C(=O)N
(2)InChI: InChI=1S/C14H14N2O/c15-14(17)13-9-5-1-3-7-11(9)16-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,15,17)
(3)InChIKey: MCGYLXFQIZWHLI-UHFFFAOYSA-N

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