Mrv0541 02241212192D          

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M  END
> <DATABASE_ID>
CHEM024106

> <DATABASE_NAME>
chemdb

> <SMILES>
CCCCCCCCCCCCCCCCCCC(O)CCCCCCCCCCCCC

> <INCHI_IDENTIFIER>
InChI=1S/C32H66O/c1-3-5-7-9-11-13-15-16-17-18-19-21-23-25-27-29-31-32(33)30-28-26-24-22-20-14-12-10-8-6-4-2/h32-33H,3-31H2,1-2H3

> <INCHI_KEY>
AAJMNFSMEOFKKL-UHFFFAOYSA-N

> <FORMULA>
C32H66O

> <MOLECULAR_WEIGHT>
466.8658

> <EXACT_MASS>
466.511366734

> <JCHEM_ACCEPTOR_COUNT>
1

> <JCHEM_AVERAGE_POLARIZABILITY>
68.48455381990749

> <JCHEM_BIOAVAILABILITY>
0

> <JCHEM_DONOR_COUNT>
1

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
dotriacontan-14-ol

> <ALOGPS_LOGP>
10.62

> <JCHEM_LOGP>
13.303204655666665

> <ALOGPS_LOGS>
-7.66

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
0

> <JCHEM_PHYSIOLOGICAL_CHARGE>
0

> <JCHEM_PKA_STRONGEST_ACIDIC>
18.484172992642346

> <JCHEM_PKA_STRONGEST_BASIC>
-1.2748227330182367

> <JCHEM_POLAR_SURFACE_AREA>
20.23

> <JCHEM_REFRACTIVITY>
150.7037

> <JCHEM_ROTATABLE_BOND_COUNT>
29

> <JCHEM_RULE_OF_FIVE>
0

> <ALOGPS_SOLUBILITY>
1.03e-05 g/l

> <JCHEM_TRADITIONAL_IUPAC>
dotriacontan-14-ol

> <JCHEM_VEBER_RULE>
0

> <NAME>
Dotriacontan-14-ol

> <CAS>
917473-64-4

$$$$