CAS
90931-33-2 Purity
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90931-33-2 Purity
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(-)-trans-Myrtanyl acetate
CAS
90934-53-5
Catalog Number
ACM90934535
Category
Other Products
Molecular Weight
196.29
Molecular Formula
C12H20O2
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Specification
Synonyms
(1S,2S)-6,6-DIMETHYLBICYCLO[3.1.1]HEPTANE-2-METHYL ACETATE;(-)-TRANS-MYRTANYL ACETATE;(-)-TRANS-MYRTANYL ACETATE, TERPENE STAN DARD
Density
0.990 g/mL at 20 °C(lit.)
What is the molecular formula of (-)-trans-Myrtanyl acetate?
The molecular formula of (-)-trans-Myrtanyl acetate is C12H20O2.
What is the IUPAC name of (-)-trans-Myrtanyl acetate?
The IUPAC name of (-)-trans-Myrtanyl acetate is [(1S,2R,5S)-6,6-dimethyl-2-bicyclo[3.1.1]heptanyl]methyl acetate.
What is the InChI of (-)-trans-Myrtanyl acetate?
The InChI of (-)-trans-Myrtanyl acetate is InChI=1S/C12H20O2/c1-8(13)14-7-9-4-5-10-6-11(9)12(10,2)3/h9-11H,4-7H2,1-3H3/t9-,10-,11-/m0/s1.
What is the InChIKey of (-)-trans-Myrtanyl acetate?
The InChIKey of (-)-trans-Myrtanyl acetate is UWHRPSXEBAXLDR-DCAQKATOSA-N.
What is the Canonical SMILES of (-)-trans-Myrtanyl acetate?
The Canonical SMILES of (-)-trans-Myrtanyl acetate is CC(=O)OCC1CCC2CC1C2(C)C.
What is the Isomeric SMILES of (-)-trans-Myrtanyl acetate?
The Isomeric SMILES of (-)-trans-Myrtanyl acetate is CC(=O)OC[C@@H]1CC[C@H]2C[C@@H]1C2(C)C.
What is the molecular weight of (-)-trans-Myrtanyl acetate?
The molecular weight of (-)-trans-Myrtanyl acetate is 196.29 g/mol.
What is the XLogP3-AA value of (-)-trans-Myrtanyl acetate?
The XLogP3-AA value of (-)-trans-Myrtanyl acetate is 3.1.
How many hydrogen bond donor counts does (-)-trans-Myrtanyl acetate have?
(-)-trans-Myrtanyl acetate has 0 hydrogen bond donor counts.
How many rotatable bond counts does (-)-trans-Myrtanyl acetate have?
(-)-trans-Myrtanyl acetate has 3 rotatable bond counts.
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