ethane;1-ethyl-4-(4-propan-2-ylphenyl)benzene

C19H26 — CID 143715376

IUPACethane;1-ethyl-4-(4-propan-2-ylphenyl)benzene
SMILESCC.CCc1ccc(-c2ccc(C(C)C)cc2)cc1
InChIInChI=1S/C17H20.C2H6/c1-4-14-5-7-16(8-6-14)17-11-9-15(10-12-17)13(2)3;1-2/h5-13H,4H2,1-3H3;1-2H3
InChIKeyGZVDPQYLIBPPKC-UHFFFAOYSA-N
MW254.42 g/mol
LogP6.07
Rot. Bonds3

About ethane;1-ethyl-4-(4-propan-2-ylphenyl)benzene

ethane;1-ethyl-4-(4-propan-2-ylphenyl)benzene (PubChem CID 143715376) has the molecular formula C19H26 and a molecular weight of 254.42 g/mol. Its IUPAC name is ethane;1-ethyl-4-(4-propan-2-ylphenyl)benzene.

Molecular Properties

Compound Nameethane;1-ethyl-4-(4-propan-2-ylphenyl)benzene
PubChem CID143715376
Molecular FormulaC19H26
Molecular Weight254.42 g/mol
Exact Mass254.20
IUPAC Nameethane;1-ethyl-4-(4-propan-2-ylphenyl)benzene
SMILESCC.CCc1ccc(-c2ccc(C(C)C)cc2)cc1
InChIInChI=1S/C17H20.C2H6/c1-4-14-5-7-16(8-6-14)17-11-9-15(10-12-17)13(2)3;1-2/h5-13H,4H2,1-3H3;1-2H3
InChIKeyGZVDPQYLIBPPKC-UHFFFAOYSA-N
XLogP6.07
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500254.42
LogP ≤ 56.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

ethane;1-ethyl-4-propan-2-ylbenzene
CID 145053715
ethane;1-ethyl-4-(4-ethylphenyl)benzene;phenol;1-phenyl-4-propan-2-ylbenzene
CID 160505976
cumene;1,4-diethylbenzene;1-ethyl-4-(4-ethylphenyl)benzene;methane;methanol
CID 159437304
1-[4-(4-ethylphenyl)phenyl]ethanol
CID 139710223
1-ethyl-4-(4-propan-2-ylphenoxy)benzene
CID 66612955
1-butyl-4-ethylbenzene;ethane;1-ethyl-4-propan-2-ylbenzene;methane
CID 176687496
cumene;1,4-diethylbenzene;1-ethyl-4-(4-ethylphenyl)benzene;methane;phenol
CID 159077925
1,4-bis[(4-ethylphenyl)methyl]benzene;ethane;1-ethyl-4-[[4-[4-[(4-ethylphenyl)methyl]phenyl]phenyl]methyl]benzene
CID 163605506
ethane;molecular hydrogen;1-phenyl-4-propan-2-ylbenzene;propane
CID 142053065
1-(3-methylbutyl)-4-(4-propan-2-ylphenyl)benzene
CID 164757723
1,4-diethylbenzene;ethane
CID 91207141
1-heptyl-4-(4-propan-2-ylphenyl)benzene
CID 58842076

Frequently Asked Questions

What is the IUPAC name of ethane;1-ethyl-4-(4-propan-2-ylphenyl)benzene?
The IUPAC name of ethane;1-ethyl-4-(4-propan-2-ylphenyl)benzene (CID 143715376) is ethane;1-ethyl-4-(4-propan-2-ylphenyl)benzene.
What is the SMILES notation for ethane;1-ethyl-4-(4-propan-2-ylphenyl)benzene?
The canonical SMILES for ethane;1-ethyl-4-(4-propan-2-ylphenyl)benzene is CC.CCc1ccc(-c2ccc(C(C)C)cc2)cc1.
What is the InChIKey of ethane;1-ethyl-4-(4-propan-2-ylphenyl)benzene?
The InChIKey is GZVDPQYLIBPPKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20.C2H6/c1-4-14-5-7-16(8-6-14)17-11-9-15(10-12-17)13(2)3;1-2/h5-13H,4H2,1-3H3;1-2H3.
What are the key properties of ethane;1-ethyl-4-(4-propan-2-ylphenyl)benzene?
ethane;1-ethyl-4-(4-propan-2-ylphenyl)benzene has a molecular weight of 254.42 g/mol, XLogP of 6.07, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;1-ethyl-4-(4-propan-2-ylphenyl)benzene is sourced from PubChem (CID 143715376), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).