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1-Ethyl-1-methylindan

HCID 41840
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Basic information

CAS
56298-75-0
Standard SMILES
CCC1(C)CCc2ccccc21
InChIKey
PVWWWDUASYPYLN-UHFFFAOYSA-N
Molecular formula
C12H16
Average molar mass
160.25 g/mol
Monoisotopic mass
160.12520051

Names & identifiers

Preferred name
1-Ethyl-1-methylindan
IUPAC
3-ethyl-3-methyl-1,2-dihydroindene
English name
1-Ethyl-1-methylindan
Molecular formula
C12H16
Molecular weight
160.26

Names & synonyms

56298-75-01-Ethyl-1-methylindan2,3-dihydro-1-ethyl-1-methyl-1h-indene1-Ethyl-1-methyl-2,3-dihydro-1H-indene1H-Indene, 1-ethyl-2,3-dihydro-1-methyl-1-Ethyl-1-methylindane #SCHEMBL7549093SCHEMBL30298333SCHEMBL30298335DTXSID30971739PVWWWDUASYPYLN-UHFFFAOYSA-N1-Ethyl-2,3-dihydro-1-methyl-1H-indene

Database identifiers

CAS
56298-75-0
PubChem CID
41840
DTXSID
DTXSID30971739
Nikkaji
J114.089B

Properties

Computed structural properties

XLogP
4.2
Topological polar surface area
0 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
0
Rotatable bonds
1
Heavy atoms
12
Formal charge
0
Complexity
161

Experimental & physicochemical properties

SpringerMaterials PropertiesDensity

Related reactions

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Compound notes

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