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Reference substances

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IUPAC name:
2-isopropenyl-5-methylcyclohexanol

Inventory

EC number:
201-940-6
EC name:
Isopulegol
CAS number:
89-79-2
CAS number:
89-79-2
Synonyms
Names:
(1R,2S,5R)‐5‐methyl‐2‐(prop‐1‐en‐2‐yl)cyclohexan‐1‐ol
Cyclohexanol, 5-methyl-2-(1-methylethenyl)-, (1R,2S,5R)-
Cyclohexanol, 5-methyl-2-(1-methylethenyl)-, [1R-(1?,2ß,5?)]-
Identifier:
IUPAC name
(1R,2S,5R)‐5‐methyl‐2‐(prop‐1‐en‐2‐yl)cyclohexan‐1‐ol
Identifier:
other: SMILES notation
CC(=C)[C@@H]1CC[C@@H](C)C[C@H]1O
Identifier:
other: InChl
InChI=1S/C10H18O/c1-7(2)9-5-4-8(3)6-10(9)11/h8-11H,1,4-6H2,2-3H3/t8-,9+,10-/m1/s1

Molecular and structural information

Molecular formula:
C10H18O
Molecular weight:
154.249
SMILES notation:
C[C@@H]1CC[C@H]([C@H](O)C1)C(=C)C
InChl:
InChI=1/C10H18O/c1-7(2)9-5-4-8(3)6-10(9)11/h8-11H,1,4-6H2,2-3H3
Structural formula:
Chemical structure

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