Mrv1652303192001523D          

 11 11  0  0  0  0            999 V2000
   -1.8804    1.2308    0.8796 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6984    0.1643   -1.1407 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9570    1.3282   -0.3522 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1895    0.4323    1.1058 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5392   -0.7983   -0.9266 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1475   -0.6163    1.3208 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0479   -0.7761   -1.1676 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7810    0.2625    0.0082 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8898    0.3420   -0.0235 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7281   -0.8114    0.1197 C   0  0  2  0  0  0  0  0  0  0  0  0
   -1.4220   -2.0076    0.2867 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  8  2  0  0  0  0
  2  8  1  0  0  0  0
  3  9  1  0  0  0  0
  4  6  1  0  0  0  0
  4  9  2  0  0  0  0
  5  7  1  0  0  0  0
  5  9  1  0  0  0  0
  6 10  1  0  0  0  0
  7 10  1  0  0  0  0
  8 10  1  0  0  0  0
 10 11  1  0  0  0  0
M  END
> <DATABASE_ID>
CDB000715

> <DATABASE_NAME>
CDB

> <SMILES>
CC(=C)[C@@]1(O)CCC(C)=CC1

> <INCHI_IDENTIFIER>
InChI=1S/C10H16O/c1-8(2)10(11)6-4-9(3)5-7-10/h4,11H,1,5-7H2,2-3H3/t10-/m0/s1

> <INCHI_KEY>
OVKDFILSBMEKLT-JTQLQIEISA-N

> <FORMULA>
C10H16O

> <MOLECULAR_WEIGHT>
152.237

> <EXACT_MASS>
152.120115135

> <JCHEM_ACCEPTOR_COUNT>
1

> <JCHEM_ATOM_COUNT>
27

> <JCHEM_AVERAGE_POLARIZABILITY>
18.030301684677916

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
1

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
(1R)-4-methyl-1-(prop-1-en-2-yl)cyclohex-3-en-1-ol

> <ALOGPS_LOGP>
2.42

> <JCHEM_LOGP>
2.0605128866666664

> <ALOGPS_LOGS>
-1.80

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
1

> <JCHEM_PHYSIOLOGICAL_CHARGE>
0

> <JCHEM_PKA_STRONGEST_ACIDIC>
19.233874423926363

> <JCHEM_PKA_STRONGEST_BASIC>
-0.946903326974608

> <JCHEM_POLAR_SURFACE_AREA>
20.23

> <JCHEM_REFRACTIVITY>
48.008399999999995

> <JCHEM_ROTATABLE_BOND_COUNT>
1

> <JCHEM_RULE_OF_FIVE>
1

> <ALOGPS_SOLUBILITY>
2.41e+00 g/l

> <JCHEM_TRADITIONAL_IUPAC>
(1R)-4-methyl-1-(prop-1-en-2-yl)cyclohex-3-en-1-ol

> <JCHEM_VEBER_RULE>
1

> <Cannabis Database ID>
CDB000715

> <GENERIC_NAME>
1,8-Menthadien-4-ol

$$$$