1,2-diethyl-3-(1-phenylethenyl)benzene

C18H20 — CID 18968379

IUPAC1,2-diethyl-3-(1-phenylethenyl)benzene
SMILESC=C(c1ccccc1)c1cccc(CC)c1CC
InChIInChI=1S/C18H20/c1-4-15-12-9-13-18(17(15)5-2)14(3)16-10-7-6-8-11-16/h6-13H,3-5H2,1-2H3
InChIKeyCIVKSBZCDIBPLE-UHFFFAOYSA-N
MW236.36 g/mol
LogP4.87
Rot. Bonds4

About 1,2-diethyl-3-(1-phenylethenyl)benzene

1,2-diethyl-3-(1-phenylethenyl)benzene (PubChem CID 18968379) has the molecular formula C18H20 and a molecular weight of 236.36 g/mol. Its IUPAC name is 1,2-diethyl-3-(1-phenylethenyl)benzene.

Molecular Properties

Compound Name1,2-diethyl-3-(1-phenylethenyl)benzene
PubChem CID18968379
Molecular FormulaC18H20
Molecular Weight236.36 g/mol
Exact Mass236.16
IUPAC Name1,2-diethyl-3-(1-phenylethenyl)benzene
SMILESC=C(c1ccccc1)c1cccc(CC)c1CC
InChIInChI=1S/C18H20/c1-4-15-12-9-13-18(17(15)5-2)14(3)16-10-7-6-8-11-16/h6-13H,3-5H2,1-2H3
InChIKeyCIVKSBZCDIBPLE-UHFFFAOYSA-N
XLogP4.87
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.36
LogP ≤ 54.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

(2,3-diethylphenyl)-phenylmethanone;phosphenous acid
CID 174596350
1-ethyl-2-(3-phenylbuta-1,3-dien-2-yl)benzene
CID 22151876
2-[2-(2,3-diethylbenzoyl)phenyl]benzoic acid
CID 175134431
2,3-diethylbenzamide;hydrofluoride
CID 175203586
N-[[2-ethyl-3-(1-phosphanylideneethyl)phenyl]methyl]-1-phenylethenamine
CID 143421302
2-ethyl-3-(hydroxymethyl)benzoic acid
CID 141102852
sodium;(2-ethylphenyl)-phenylmethanone;hydride
CID 175475173
(2-benzoyl-3,4-diethylphenyl)-phenylmethanone
CID 175879744
1-ethyl-2-(2-phenylprop-2-enyl)benzene
CID 18968382
1,2-diphenylethane-1,2-dione;1-ethenyl-2-ethylbenzene
CID 174766934
2-(bromomethyl)-3-ethylbenzoic acid
CID 66619635
azane;1-phenyl-2-(2,3,4-triethylphenyl)ethane-1,2-dione;hydrobromide
CID 174431283

Frequently Asked Questions

What is the IUPAC name of 1,2-diethyl-3-(1-phenylethenyl)benzene?
The IUPAC name of 1,2-diethyl-3-(1-phenylethenyl)benzene (CID 18968379) is 1,2-diethyl-3-(1-phenylethenyl)benzene.
What is the SMILES notation for 1,2-diethyl-3-(1-phenylethenyl)benzene?
The canonical SMILES for 1,2-diethyl-3-(1-phenylethenyl)benzene is C=C(c1ccccc1)c1cccc(CC)c1CC.
What is the InChIKey of 1,2-diethyl-3-(1-phenylethenyl)benzene?
The InChIKey is CIVKSBZCDIBPLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20/c1-4-15-12-9-13-18(17(15)5-2)14(3)16-10-7-6-8-11-16/h6-13H,3-5H2,1-2H3.
What are the key properties of 1,2-diethyl-3-(1-phenylethenyl)benzene?
1,2-diethyl-3-(1-phenylethenyl)benzene has a molecular weight of 236.36 g/mol, XLogP of 4.87, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-diethyl-3-(1-phenylethenyl)benzene is sourced from PubChem (CID 18968379), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).