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Molecule
ID:125107
Structure
Similarity
Functional Group
Text
General Information
Structure
Molecular Formula
C₅H₁₀
Molecular Mass
70.1329
Exact Mass
70.07825032
Charge
0
InChI
InChI=1S/C5H10/c1-4-3-5(4)2/h4-5H,3H2,1-2H3
InChIKey
VKJLDXGFBJBTRQ-UHFFFAOYSA-N
Canonic Smiles
CC1CC1C
Isomeric Smiles
CC1CC1C
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
1.9077442
LogD (pH = 7.4)
1.9077442
Log P
1.9077442
Molar Refractivity
22.9002
Polarizability
9.23521
Polar Surface Area
0.0
Rotatable Bonds
0
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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IUPAC name
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IUPAC Traditional name
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Synonyms
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Properties
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Physical Property
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Molecular Spectra
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Data Source
Academic Data
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1,2-Dimethylcyclopropane
PubChem
102832
Names and Identifiers
IUPAC name
1,2-dimethylcyclopropane
IUPAC Traditional name
1,2-dimethylcyclopropane
Synonyms
1,2-Dimethylcyclopropane
Registration numbers
PubChem CID
102832
CAS Number
2511-95-7
Wikipedia Title
1,2-Dimethylcyclopropane
Chemspider ID
92890
PubChem SID
162219457
Properties
Physical Property
Refractive Index
cis: 1.3829 (20 °C)
trans: 1.3713 (20 °C)
Source
Density
cis: 0.6889 g/cm3
trans: 0.6648 g/cm3
Source
Melting Point
cis: -140 °C
trans: -149.6 °C
Source
Boiling Point
cis: 37 °C
trans: 28.2 °C
Source
Molecule Details
Wikipedia
1,2-Dimethylcyclopropane
References
PubChem Literature
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Bioactivity
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PubChem CID
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CAS Number
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