Mrv0541 02241212472D          

 11 11  0  0  0  0            999 V2000
   -1.7209   -0.7955    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0065   -1.2080    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0065   -2.0330    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7209   -2.4456    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4354   -2.0330    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4354   -1.2080    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0892   -0.2209    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7209   -3.2706    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4354   -3.6831    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0065   -3.6831    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3453   -0.2062    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  6  1  0  0  0  0
  2  3  2  0  0  0  0
  3  4  1  0  0  0  0
  4  5  1  0  0  0  0
  5  6  1  0  0  0  0
  1  7  1  0  0  0  0
  4  8  1  0  0  0  0
  8  9  1  0  0  0  0
  8 10  1  0  0  0  0
  1 11  1  0  0  0  0
M  END
> <DATABASE_ID>
CHEM025854

> <DATABASE_NAME>
chemdb

> <SMILES>
CC(C)C1CCC(C)(O)C=C1

> <INCHI_IDENTIFIER>
InChI=1S/C10H18O/c1-8(2)9-4-6-10(3,11)7-5-9/h4,6,8-9,11H,5,7H2,1-3H3

> <INCHI_KEY>
IZXYHAXVIZHGJV-UHFFFAOYSA-N

> <FORMULA>
C10H18O

> <MOLECULAR_WEIGHT>
154.2493

> <EXACT_MASS>
154.135765198

> <JCHEM_ACCEPTOR_COUNT>
1

> <JCHEM_AVERAGE_POLARIZABILITY>
18.93206382172706

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
1

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
1-methyl-4-(propan-2-yl)cyclohex-2-en-1-ol

> <ALOGPS_LOGP>
2.71

> <JCHEM_LOGP>
2.3738627923333335

> <ALOGPS_LOGS>
-2.80

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
1

> <JCHEM_PHYSIOLOGICAL_CHARGE>
0

> <JCHEM_PKA_STRONGEST_ACIDIC>
18.171179768374394

> <JCHEM_PKA_STRONGEST_BASIC>
-1.4117259693130402

> <JCHEM_POLAR_SURFACE_AREA>
20.23

> <JCHEM_REFRACTIVITY>
48.57449999999999

> <JCHEM_ROTATABLE_BOND_COUNT>
1

> <JCHEM_RULE_OF_FIVE>
1

> <ALOGPS_SOLUBILITY>
2.42e-01 g/l

> <JCHEM_TRADITIONAL_IUPAC>
4-isopropyl-1-methylcyclohex-2-en-1-ol

> <JCHEM_VEBER_RULE>
1

> <NAME>
p-Menth-cis-2-en-1-ol

> <SYNONYMS>
p-Menth-trans-2-en-1-ol

$$$$