Molecular Identity
4-tert-Butyltoluene
1-tert-butyl-4-methylbenzene
PubChem CID: 7390
2D Structure
Properties
C11H16
Molecular Formula
148.24
Molecular Weight
g/mol
148.1252
Exact Mass
Da
4.5
XLogP
Drug-like (Lipinski: < 5)
0
TPSA
Good oral absorption (< 140 A²)
0
H-Bond Donors
0
H-Bond Acceptors
110
Complexity
SMILES
Canonical SMILES
SMILES: Synonyms(20)
4-tert-Butyltoluene98-51-1p-tert-Butyltoluene1-tert-Butyl-4-methylbenzene4-T-BUTYLTOLUENE1-Methyl-4-tert-butylbenzenep-Methyl-tert-butylbenzeneToluene, p-tert-butyl-Benzene, 1-(1,1-dimethylethyl)-4-methyl-4-tert-Butyl-1-methylbenzenePTBT4-Methyl-tert-butylbenzene8-Methylparacymenep-TBTDTXSID1024704
Data from PubChem (NCBI)
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Drug Network
Trials and conditions connected to 4-tert-Butyltoluene
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