ethane;1-ethyl-4-phenylbenzene;methane

C17H24 — CID 142852812

IUPACethane;1-ethyl-4-phenylbenzene;methane
SMILESC.CC.CCc1ccc(-c2ccccc2)cc1
InChIInChI=1S/C14H14.C2H6.CH4/c1-2-12-8-10-14(11-9-12)13-6-4-3-5-7-13;1-2;/h3-11H,2H2,1H3;1-2H3;1H4
InChIKeyFFMKZXUJXYMLEX-UHFFFAOYSA-N
MW228.38 g/mol
LogP5.58
Rot. Bonds2

About ethane;1-ethyl-4-phenylbenzene;methane

ethane;1-ethyl-4-phenylbenzene;methane (PubChem CID 142852812) has the molecular formula C17H24 and a molecular weight of 228.38 g/mol. Its IUPAC name is ethane;1-ethyl-4-phenylbenzene;methane.

Molecular Properties

Compound Nameethane;1-ethyl-4-phenylbenzene;methane
PubChem CID142852812
Molecular FormulaC17H24
Molecular Weight228.38 g/mol
Exact Mass228.19
IUPAC Nameethane;1-ethyl-4-phenylbenzene;methane
SMILESC.CC.CCc1ccc(-c2ccccc2)cc1
InChIInChI=1S/C14H14.C2H6.CH4/c1-2-12-8-10-14(11-9-12)13-6-4-3-5-7-13;1-2;/h3-11H,2H2,1H3;1-2H3;1H4
InChIKeyFFMKZXUJXYMLEX-UHFFFAOYSA-N
XLogP5.58
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500228.38
LogP ≤ 55.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

acetylene;1-ethyl-4-phenylbenzene
CID 175126841
1-(4-ethylphenyl)-3,5-diphenylbenzene
CID 123998830
bicyclo[2.2.0]hexa-1,3,5-triene;ethylbenzene
CID 175075360
4-ethyl-N-[4-[4-[4-(4-ethyl-N-(4-phenylphenyl)anilino)phenyl]phenyl]phenyl]-N-(4-phenylphenyl)aniline
CID 121323857
1-ethyl-4-(2-phenylphenyl)benzene;sulfane
CID 160558702
ethane;ethylbenzene
CID 90887003
1,4-diethylbenzene;ethane;methane
CID 166131756
1,1'-biphenyl;ethylbenzene;naphthalene
CID 163537509
1,1'-biphenyl;1-tert-butyl-4-ethylbenzene
CID 142597809
1,4-bis[(4-ethylphenyl)methyl]benzene;ethane;1-ethyl-4-[[4-[4-[(4-ethylphenyl)methyl]phenyl]phenyl]methyl]benzene
CID 163605506
ethane;ethylbenzene;propane
CID 91199618
ethylcyclodecapentaene
CID 90861705

Frequently Asked Questions

What is the IUPAC name of ethane;1-ethyl-4-phenylbenzene;methane?
The IUPAC name of ethane;1-ethyl-4-phenylbenzene;methane (CID 142852812) is ethane;1-ethyl-4-phenylbenzene;methane.
What is the SMILES notation for ethane;1-ethyl-4-phenylbenzene;methane?
The canonical SMILES for ethane;1-ethyl-4-phenylbenzene;methane is C.CC.CCc1ccc(-c2ccccc2)cc1.
What is the InChIKey of ethane;1-ethyl-4-phenylbenzene;methane?
The InChIKey is FFMKZXUJXYMLEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14.C2H6.CH4/c1-2-12-8-10-14(11-9-12)13-6-4-3-5-7-13;1-2;/h3-11H,2H2,1H3;1-2H3;1H4.
What are the key properties of ethane;1-ethyl-4-phenylbenzene;methane?
ethane;1-ethyl-4-phenylbenzene;methane has a molecular weight of 228.38 g/mol, XLogP of 5.58, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;1-ethyl-4-phenylbenzene;methane is sourced from PubChem (CID 142852812), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).