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110549-07-0

Basic Information
CAS No.: 110549-07-0
Name: (R)-1,2-EPOXYHEPTANE
Article Data: 17
Molecular Structure:
Molecular Structure of 110549-07-0 ((R)-1,2-EPOXYHEPTANE)
Formula: C7H14O
Molecular Weight: 114.188
Synonyms: Oxirane,pentyl-, (2R)- (9CI);Oxirane, pentyl-, (R)-;(+)-1,2-Epoxyheptane;(R)-(+)-1,2-Epoxyheptane;(R)-1,2-Epoxyheptane;(R)-Pentyloxirane;
Density: 0.869 g/cm3
Boiling Point: 139.702 °C at 760 mmHg
Flash Point: 33.926 °C
Hazard Symbols: HarmfulXn,FlammableF
Risk Codes: 11-22-36/37/38
Safety: 16-26
Transport Information: UN1993 3/PG 2
PSA: 12.53000
LogP: 1.96550
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Specification

The Oxirane, 2-pentyl-,(2R)-, with the CAS registry number 110549-07-0, is also known as (R)-1,2-Epoxyheptane. This chemical's molecular formula is C7H14O and molecular weight is 114.19. What's more, its systematic name is 2-pentyloxirane.

Physical properties of Oxirane, 2-pentyl-,(2R)- are: (1)ACD/LogP: 2.25; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.25; (4)ACD/BCF (pH 5.5): 30.23; (5)ACD/KOC (pH 5.5): 399.33; (6)#H bond acceptors: 1; (7)#H bond donors: 0; (8)#Freely Rotating Bonds: 4; (9)Polar Surface Area: 12.53 Å2; (10)Index of Refraction: 1.431; (11)Molar Refractivity: 34.05 cm3; (12)Molar Volume: 131.3 cm3; (13)Surface Tension: 30.2 dyne/cm; (14)Density: 0.869 g/cm3; (15)Flash Point: 33.9 °C; (16)Enthalpy of Vaporization: 36.14 kJ/mol; (17)Boiling Point: 139.7 °C at 760 mmHg; (18)Vapour Pressure: 7.91 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
It is highly flammable, so you should keep it away from sources of ignition - No smoking. It is harmful if swallowed. It is irritating to eyes, respiratory system and skin. 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: CCCCCC1CO1
(2)InChI: InChI=1S/C7H14O/c1-2-3-4-5-7-6-8-7/h7H,2-6H2,1H3
(3)InChIKey: NMOFYYYCFRVWBK-UHFFFAOYSA-N