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Molecule
ID:86360
Structure
Similarity
Functional Group
Text
General Information
Structure
Molecular Formula
C₈H₁₅Cl
Molecular Mass
146.6577
Exact Mass
146.08622816
Charge
0
InChI
InChI=1S/C8H15Cl/c1-8(2)6-4-3-5-7-9/h1,3-7H2,2H3
InChIKey
INYVTNOWFXTSFY-UHFFFAOYSA-N
Canonic Smiles
ClCCCCCC(=C)C
Isomeric Smiles
ClCCCCCC(=C)C
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
3.4329932
LogD (pH = 7.4)
3.4329932
Log P
3.4329932
Molar Refractivity
43.315
Polarizability
17.039658
Polar Surface Area
0.0
Rotatable Bonds
5
Lipinski's Rule of Five
true
Data Source
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Names and Identifiers
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Registration numbers
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Properties
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Related Proteins
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Molecular Spectra
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Molecule Details
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References
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Bioactivity
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General Information
Calculated Properties
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RDKit
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JChem
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Academic Data
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Names and Identifiers
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IUPAC name
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Synonyms
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IUPAC Traditional name
Registration numbers
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PubChem SID
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PubChem CID
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MDL Number
Properties
Related Proteins
Molecular Spectra
Molecule Details
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PubChem Literature
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From Data Sources
Bioactivity
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PubChem BioAssay
Data Source
Academic Data
PubChem
15316717
Commercial Catalog
Apollo Scientific
OR2949
Names and Identifiers
IUPAC name
7-chloro-2-methylhept-1-ene
Synonyms
7-Chloro-2-methylhept-1-ene 97%
IUPAC Traditional name
7-chloro-2-methylhept-1-ene
Registration numbers
PubChem SID
162073476
PubChem CID
15316717
MDL Number
MFCD00671835
References
PubChem Literature
No Data Available
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Bioactivity
PubChem BioAssay