ethane;1-ethyl-4-(4-propylphenyl)benzene

C19H26 — CID 142388235

IUPACethane;1-ethyl-4-(4-propylphenyl)benzene
SMILESCC.CCCc1ccc(-c2ccc(CC)cc2)cc1
InChIInChI=1S/C17H20.C2H6/c1-3-5-15-8-12-17(13-9-15)16-10-6-14(4-2)7-11-16;1-2/h6-13H,3-5H2,1-2H3;1-2H3
InChIKeyJNPBBWAMDRJSFV-UHFFFAOYSA-N
MW254.42 g/mol
LogP5.89
Rot. Bonds4

About ethane;1-ethyl-4-(4-propylphenyl)benzene

ethane;1-ethyl-4-(4-propylphenyl)benzene (PubChem CID 142388235) has the molecular formula C19H26 and a molecular weight of 254.42 g/mol. Its IUPAC name is ethane;1-ethyl-4-(4-propylphenyl)benzene.

Molecular Properties

Compound Nameethane;1-ethyl-4-(4-propylphenyl)benzene
PubChem CID142388235
Molecular FormulaC19H26
Molecular Weight254.42 g/mol
Exact Mass254.20
IUPAC Nameethane;1-ethyl-4-(4-propylphenyl)benzene
SMILESCC.CCCc1ccc(-c2ccc(CC)cc2)cc1
InChIInChI=1S/C17H20.C2H6/c1-3-5-15-8-12-17(13-9-15)16-10-6-14(4-2)7-11-16;1-2/h6-13H,3-5H2,1-2H3;1-2H3
InChIKeyJNPBBWAMDRJSFV-UHFFFAOYSA-N
XLogP5.89
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms19
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500254.42
LogP ≤ 55.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of ethane;1-ethyl-4-(4-propylphenyl)benzene?
The IUPAC name of ethane;1-ethyl-4-(4-propylphenyl)benzene (CID 142388235) is ethane;1-ethyl-4-(4-propylphenyl)benzene.
What is the SMILES notation for ethane;1-ethyl-4-(4-propylphenyl)benzene?
The canonical SMILES for ethane;1-ethyl-4-(4-propylphenyl)benzene is CC.CCCc1ccc(-c2ccc(CC)cc2)cc1.
What is the InChIKey of ethane;1-ethyl-4-(4-propylphenyl)benzene?
The InChIKey is JNPBBWAMDRJSFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20.C2H6/c1-3-5-15-8-12-17(13-9-15)16-10-6-14(4-2)7-11-16;1-2/h6-13H,3-5H2,1-2H3;1-2H3.
What are the key properties of ethane;1-ethyl-4-(4-propylphenyl)benzene?
ethane;1-ethyl-4-(4-propylphenyl)benzene has a molecular weight of 254.42 g/mol, XLogP of 5.89, 4 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-propylphenyl)benzene is sourced from PubChem (CID 142388235), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).