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vitas@vitasmlab.com | |||
Chemical manufacturer since 1998 | ||||
Name | Isoborneol |
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Synonyms | 1,7,7-Trimethylnorbornan-2-Ol; 1,7,7-Trimethyl-2-Norbornanol; Bicyclo[2.2.1]Heptan-2-Ol, 1,7,7-Trimethyl- |
Molecular Structure | ![]() |
Molecular Formula | C10H18O |
Molecular Weight | 154.25 |
CAS Registry Number | 10385-78-1 |
SMILES | CC12C(C(CC1O)CC2)(C)C |
InChI | 1S/C10H18O/c1-9(2)7-4-5-10(9,3)8(11)6-7/h7-8,11H,4-6H2,1-3H3 |
InChIKey | DTGKSKDOIYIVQL-UHFFFAOYSA-N |
Density | 0.993g/cm3 (Cal.) |
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Melting point | 206°C (Expl.) |
Boiling point | 211.999°C at 760 mmHg (Cal.) |
Flash point | 65.556°C (Cal.) |
(1) | Igor V. Tetko, Vsevolod Yu. Tanchuk, Tamara N. Kasheva, and Alessandro E. P. Villa. Estimation of Aqueous Solubility of Chemical Compounds Using E-State Indices, J. Chem. Inf. Comput. Sci., 2001, 41 (6), pp 1488–1493 |
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