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CAS No.: | 95-12-5 |
---|---|
Name: | 5-Norbornene-2-methanol |
Article Data: | 101 |
Molecular Structure: | |
Formula: | C8H12O |
Molecular Weight: | 124.183 |
Synonyms: | 5-Norbornene-2-methanol(6CI,7CI,8CI);2-(Hydroxymethyl)bicyclo[2.2.1]hept-5-ene;2-Hydroxymethyl-5-norbornene;5-(Hydroxymethyl)bicyclo[2.2.1]hept-2-ene;5-Hydroxymethyl-2-norbornene;Cyclol;NSC 403110; |
EINECS: | 202-392-0 |
Density: | 1.061 g/cm3 |
Boiling Point: | 189.2 °C at 760 mmHg |
Flash Point: | 81.6 °C |
Hazard Symbols: | Xn |
Risk Codes: | 20/21/22 |
Safety: | 36/37/39-45 |
PSA: | 20.23000 |
LogP: | 1.19090 |
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The CAS register number of 5-Norbornene-2-methanol is 95-12-5. It also can be called as Bicyclo[2.2.1]hept-5-ene-2-methanol and the IUPAC name about this chemical is 5-bicyclo[2.2.1]hept-2-enylmethanol. The molecular formula about this chemical is C8H12O and the molecular weight is 124.18. It belongs to the following product categories which include Alkenes; Cyclic; Organic Building Blocks; Norbornene Derivatives and so on.
Physical properties about 5-Norbornene-2-methanol are: (1)ACD/LogP: 1.36; (2)ACD/LogD (pH 5.5): 1.36; (3)ACD/LogD (pH 7.4): 1.36; (4)ACD/BCF (pH 5.5): 6.33; (5)ACD/BCF (pH 7.4): 6.33; (6)ACD/KOC (pH 5.5): 130.34; (7)ACD/KOC (pH 7.4): 130.34; (8)#H bond acceptors: 1; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 2; (11)Polar Surface Area: 9.23Å2; (12)Index of Refraction: 1.53; (13)Molar Refractivity: 36.16 cm3; (14)Molar Volume: 117 cm3; (15)Polarizability: 14.33x10-24cm3; (16)Surface Tension: 43.9 dyne/cm; (17)Enthalpy of Vaporization: 49.51 kJ/mol; (18)Boiling Point: 189.2 °C at 760 mmHg; (19)Vapour Pressure: 0.158 mmHg at 25°C.
Uses of 5-Norbornene-2-methanol: it can be used to produce acetic acid 5-oxa-tricyclo[4.3.0.03,7]non-9-yl ester with (+-)-acetic acid-((3ar)-hexahydro-3,5-methano-cyclopenta[b]furan-6c-yl ester) at ambient temperature. This reaction will need reagent Tl(OCOCH3)3 and solvent acetic acid. The yield is about 21%.
When you are using this chemical, please be cautious about it as the following:
This chemical is harmful by inhalation, in contact with skin and if swallowed. When you are using it, wear suitable protective clothing, gloves and eye/face protection. In case of accident or if you feel unwell, seek medical advice immediately (show the label whenever possible.)
You can still convert the following datas into molecular structure:
(1)SMILES: OCC2C1\C=C/C(C1)C2
(2)InChI: InChI=1/C8H12O/c9-5-8-4-6-1-2-7(8)3-6/h1-2,6-9H,3-5H2
(3)InChIKey: LUMNWCHHXDUKFI-UHFFFAOYAW
(4)Std. InChI: InChI=1S/C8H12O/c9-5-8-4-6-1-2-7(8)3-6/h1-2,6-9H,3-5H2
(5)Std. InChIKey: LUMNWCHHXDUKFI-UHFFFAOYSA-N