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Molecule
ID:112667
Structure
Similarity
Functional Group
Text
General Information
Structure
Molecular Formula
C₁₉H₃₈
Molecular Mass
266.50502
Exact Mass
266.29735122
Charge
0
InChI
InChI=1S/C19H38/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19(2)3/h13-14,19H,4-12,15-18H2,1-3H3
InChIKey
XDBKLFODBADBED-UHFFFAOYSA-N
Canonic Smiles
CCCCCCCCCC/C=C/CCCCC(C)C
Isomeric Smiles
CCCCCCCCCC/C=C/CCCCC(C)C
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
8.391059
LogD (pH = 7.4)
8.391059
Log P
8.391059
Molar Refractivity
90.2854
Polarizability
35.610783
Polar Surface Area
0.0
Rotatable Bonds
14
Lipinski's Rule of Five
false
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Data Source
Commercial Catalog
MP Biomedicals
05225239
Academic Data
PubChem
5363114
Names and Identifiers
Synonyms
2-METHYL OCTADECENE-2
IUPAC Traditional name
2-methyloctadec-7-ene
IUPAC name
2-methyloctadec-7-ene
Registration numbers
CAS Number
35354-39-3
PubChem SID
162097472
PubChem CID
5363114
Properties
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Molecule Details
MP Biomedicals
05225239
MP Biomedicals Rare Chemical collection
References
PubChem Literature
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Bioactivity
PubChem BioAssay