5,6,7,7a,8,9,10,11-Octahydro-4H-benzo[ef]heptalene supplier

Name
5,6,7,7a,8,9,10,11-Octahydro-4H-benzo[ef]heptalene
EINECS
CAS No. 65875-05-0
Article Data4
CAS DataBase
Density 0.984
Solubility
Melting Point
Formula C₁₅H₂₀
Boiling Point 311.926°C at 760 mmHg
Molecular Weight 200.32
Flash Point 146.447°C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 4H-Benzo[ef]heptalene,5,6,7,7a,8,9,10,11-octahydro-;
PSA 0.00000
LogP 4.22300

5,6,7,7a,8,9,10,11-Octahydro-4H-benzo[ef]heptalene Specification

The 5,6,7,7a,8,9,10,11-Octahydro-4H-benzo[ef]heptalene with the cas number 65875-05-0 is also called 4H-Benzo[ef]heptalene,5,6,7,7a,8,9,10,11-octahydro-. Its molecular formula is C₁₅H₂₀. This chemical is a kind of organics. It should be stored in dry and cool environment.

Properties Computed from Structure: (1)XLogP3-AA: 5.3; (2)H-Bond Donor: 0; (3)H-Bond Acceptor: 0; (4)Rotatable Bond Count: 0; (5)Exact Mass: 200.156501; (6)MonoIsotopic Mass: 200.156501; (7)Topological Polar Surface Area: 0; (8)Heavy Atom Count: 15; (9)Formal Charge: 0; (10)Complexity: 188; (11)Isotope Atom Count: 0; (12)Defined Atom StereoCenter Count: 0; (13)Undefined Atom StereoCenter Count: 0; (14)Defined Bond StereoCenter Count: 0; (15)Undefined Bond StereoCenter Count: 0; (16)Covalently-Bonded Unit Count: 1.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: C1CCC2=C3C(C1)CCCCC3=CC=C2
(2)InChI: InChI=1S/C15H20/c1-3-8-13-10-5-11-14-9-4-2-7-12(6-1)15(13)14/h5,10-12H,1-4,6-9H2
(3)InChIKey: ZQXLJPATXCLKDN-UHFFFAOYSA-N

Product Name

5,6,7,7a,8,9,10,11-Octahydro-4H-benzo[ef]heptalene

5,6,7,7a,8,9,10,11-Octahydro-4H-benzo[ef]heptalene Specification

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