DimethanooCtahydronaphthalene

Product Information

Molecular Formula:
C12H16
Molecular Weight:
160.26
Synonyms
1,2,3,4,4a,5,8,8a-Octahydro-1,4:5,8-dimethanonaphthalene
IUPAC Name
tetracyclo[6.2.1.13,6.02,7]dodec-4-ene
Canonical SMILES
C1CC2CC1C3C2C4CC3C=C4
InChI
InChI=1S/C12H16/c1-2-8-5-7(1)11-9-3-4-10(6-9)12(8)11/h1-2,7-12H,3-6H2
InChI Key
XBFJAVXCNXDMBH-UHFFFAOYSA-N
Boiling Point
93 ℃/11 mmHg
Flash Point
85 ℃
Purity
>96.0%(GC)
Density
1.073
Appearance
Colorless to Almost colorless clear liquid
Refractive Index
1.52

Safety Information

Hazards
H302+H312+H332:
Harmful if swallowed.
Harmful in contact with skin.
Harmful if inhaled.
Precautionary Statement
P261:
Avoid breathing dust, fumes, gas, mist, vapours, spray. [As modified by IV ATP].
P264:
Wash thoroughly after handling.
P280:
Wear protective gloves/protective clothing/eye protection/face protection.
P302+P352+P312:
IF ON SKIN:
Wash with plenty of soap and water.
Call a POISON CENTER or doctor/physician if you feel unwell.
P304+P340+P312:
IF INHALED:
Remove person to fresh air and keep comfortable for breathing.
Call a POISON CENTER or doctor/physician if you feel unwell.
P501:
Dispose of contents/container in accordance with local/regional/national/international regulations.

Computed Properties

XLogP3
3.5
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
0
Rotatable Bond Count
0
Exact Mass
160.125200510 g/mol
Monoisotopic Mass
160.125200510 g/mol
Topological Polar Surface Area
0Ų
Heavy Atom Count
12
Formal Charge
0
Complexity
229
Isotope Atom Count
0
Defined Atom Stereocenter Count
0
Undefined Atom Stereocenter Count
6
Defined Bond Stereocenter Count
0
Undefined Bond Stereocenter Count
0
Covalently-Bonded Unit Count
1
Compound Is Canonicalized
Yes

Patents

Publication Number Title Priority Date
WO-2021250905-A1 Roll body, method for manufacturing same, film, and method for manufacturing same 2020-06-12
JP-2021171941-A Multi-layer structure 2020-04-21
US-2021302641-A1 Polarizing laminate and image display device including the same 2020-03-31
JP-2021149060-A Reflective material 2020-03-23
JP-2021149061-A Reflective material 2020-03-23
JP-2021149062-A Reflective material 2020-03-23
WO-2021138651-A1 Improved shelf life mass polymerizable polycycloolefin compositions as optical materials 2020-01-02
US-2021198392-A1 UV ACTIVE DERIVATIVES OF Pd(AcAc)2 CATALYZED POLYCYCLOOLEFIN COMPOSITIONS AS OPTICAL MATERIALS 2019-12-30
US-2021162692-A1 Direct compression molded ophthalmic devices 2019-12-02
DE-102020214705-A1 Lens design and process for their manufacture 2019-11-26
The molarity calculator equation

Mass (g) = Concentration (mol/L) × Volume (L) × Molecular Weight (g/mol)

The dilution calculator equation

Concentration (start) × Volume (start) = Concentration (final) × Volume (final)

This equation is commonly abbreviated as: C1V1 = C2V2

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