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2,3-Diethyltoluene

HCID 33046
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Basic information

CAS
13632-93-4
Standard SMILES
CCc1cccc(C)c1CC
InChIKey
LRJOXARIJKBUFE-UHFFFAOYSA-N
Molecular formula
C11H16
Average molar mass
148.24 g/mol
Monoisotopic mass
148.12520051

Names & identifiers

Preferred name
2,3-Diethyltoluene
IUPAC
1,2-diethyl-3-methylbenzene

Names & synonyms

1,2-diethyl-3-methylbenzeneBenzene, 1,2-diethyl-3-methyl-2,3-DiethyltolueneToluene, 2,3-diethyl-1-METHYL-2,3-DIETHYLBENZENEUNII-F77THC362QF77THC362QDTXSID40275013RefChem:197327DTXCID20226462LRJOXARIJKBUFE-UHFFFAOYSA-N13632-93-4
Show more names
SCHEMBL169506SCHEMBL458201SCHEMBL817742SCHEMBL2469925SCHEMBL8348913SCHEMBL8352830SCHEMBL9620485SCHEMBL11461214

Database identifiers

CAS
13632-93-4
PubChem CID
33046
DTXSID
DTXSID40275013
UNII
F77THC362Q
Nikkaji
J437.521A

Properties

Computed structural properties

XLogP
3.9
Topological polar surface area
0 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
0
Rotatable bonds
2
Heavy atoms
11
Formal charge
0
Complexity
107

Related reactions

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Compound notes

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