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247133-23-9

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Basic Information
CAS No.: 247133-23-9
Name: 2,3,4,5-TETRAHYDRO-1H-BENZO[C]AZEPIN-8-OL
Molecular Structure:
Molecular Structure of 247133-23-9 (2,3,4,5-TETRAHYDRO-1H-BENZO[C]AZEPIN-8-OL)
Formula: C10H13NO
Molecular Weight: 163.219
Synonyms: 2,3,4,5-tetrahydro-1H-2-benzazepin-8-ol;
Density: 1.099 g/cm3
Boiling Point: 322.751 °C at 760 mmHg
Flash Point: 159.242 °C
Hazard Symbols: Xn
Risk Codes: 22
PSA: 32.26000
LogP: 1.75680
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Specification

The 1H-2-Benzazepin-8-ol,2,3,4,5-tetrahydro- has the CAS registry number 247133-23-9. This chemical's molecular formula is C10H13NO and molecular weight is 163.22. What's more, its systematic name is 2,3,4,5-tetrahydro-1H-2-benzazepin-8-ol. 

Physical properties of 1H-2-Benzazepin-8-ol,2,3,4,5-tetrahydro- are: (1)ACD/LogP: 1.66; (2)# of Rule of 5 Violations: 0; (3)ACD/BCF (pH 5.5): 1; (4)ACD/BCF (pH 7.4): 1; (5)ACD/KOC (pH 5.5): 1; (6)ACD/KOC (pH 7.4): 1; (7)#H bond acceptors: 2; (8)#H bond donors: 2; (9)#Freely Rotating Bonds: 1; (10)Polar Surface Area: 32.26 Å2; (11)Index of Refraction: 1.564; (12)Molar Refractivity: 48.269 cm3; (13)Molar Volume: 148.464 cm3; (14)Polarizability: 19.135×10-24cm3; (15)Surface Tension: 43.538 dyne/cm; (16)Density: 1.099 g/cm3; (17)Flash Point: 159.242 °C; (18)Enthalpy of Vaporization: 58.708 kJ/mol; (19)Boiling Point: 322.751 °C at 760 mmHg.

You can still convert the following datas into molecular structure:
(1)SMILES: Oc1ccc2c(c1)CNCCC2
(2)InChI: InChI=1S/C10H13NO/c12-10-4-3-8-2-1-5-11-7-9(8)6-10/h3-4,6,11-12H,1-2,5,7H2
(3)InChIKey: ASPWWXIBCWONIM-UHFFFAOYSA-N