-
Name
tricyclo[4.1.0.0~1,3~]heptane
- EINECS
- CAS No. 174-73-2
- Density 1.05 g/cm3
- Solubility
- Melting Point
- Formula C7H10
- Boiling Point 117.6 °C at 760 mmHg
- Molecular Weight 94.1564
- Flash Point
- Transport Information
- Appearance
- Safety
- Risk Codes
-
Molecular Structure
- Hazard Symbols
- Synonyms
- PSA
- LogP
Tricyclo[4.1.0.01,3]heptane(7CI,8CI,9CI) Specification
The Tricyclo[4.1.0.01,3]heptane(7CI,8CI,9CI) has CAS registry number 174-73-2. Its molecular formula is C7H10 and molecular weight is 94.154300. What's more, its systematic name is Tricyclo[4.1.0.01,3]heptane.
Physical properties about the Tricyclo[4.1.0.01,3]heptane(7CI,8CI,9CI) are: (1)ACD/LogP: 2.50; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.5; (4)ACD/LogD (pH 7.4): 2.5; (5)ACD/BCF (pH 5.5): 46.39; (6)ACD/BCF (pH 7.4): 46.39; (7)ACD/KOC (pH 5.5): 542.54; (8)ACD/KOC (pH 7.4): 542.54; (9)#H bond acceptors: 0; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 0 Å2; (13)Index of Refraction: 1.546; (14)Molar Refractivity: 28.28 cm3; (15)Molar Volume: 89.2 cm3; (16)Surface Tension: 33 dyne/cm; (17)Density: 1.05 g/cm3; (18)Enthalpy of Vaporization: 34.11 kJ/mol; (19)Boiling Point: 117.6 °C at 760 mmHg; (20)Vapour Pressure: 20.7 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1) SMILES: C1C3CCC2CC123
(2) InChI: InChI=1/C7H10/c1-2-6-4-7(6)3-5(1)7/h5-6H,1-4H2
(3) InChIKey: JEATYLXCUMDKCF-UHFFFAOYAH
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