1,2,3,4-tetramethyl-5-(1-phenylethenyl)benzene

C18H20 — CID 4285324

IUPAC1,2,3,4-tetramethyl-5-(1-phenylethenyl)benzene
SMILESC=C(c1ccccc1)c1cc(C)c(C)c(C)c1C
InChIInChI=1S/C18H20/c1-12-11-18(15(4)14(3)13(12)2)16(5)17-9-7-6-8-10-17/h6-11H,5H2,1-4H3
InChIKeyNHMKJHNWCPMTFY-UHFFFAOYSA-N
MW236.36 g/mol
LogP4.98
Rot. Bonds2

About 1,2,3,4-tetramethyl-5-(1-phenylethenyl)benzene

1,2,3,4-tetramethyl-5-(1-phenylethenyl)benzene (PubChem CID 4285324) has the molecular formula C18H20 and a molecular weight of 236.36 g/mol. Its IUPAC name is 1,2,3,4-tetramethyl-5-(1-phenylethenyl)benzene.

Molecular Properties

Compound Name1,2,3,4-tetramethyl-5-(1-phenylethenyl)benzene
PubChem CID4285324
Molecular FormulaC18H20
Molecular Weight236.36 g/mol
Exact Mass236.16
IUPAC Name1,2,3,4-tetramethyl-5-(1-phenylethenyl)benzene
SMILESC=C(c1ccccc1)c1cc(C)c(C)c(C)c1C
InChIInChI=1S/C18H20/c1-12-11-18(15(4)14(3)13(12)2)16(5)17-9-7-6-8-10-17/h6-11H,5H2,1-4H3
InChIKeyNHMKJHNWCPMTFY-UHFFFAOYSA-N
XLogP4.98
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.36
LogP ≤ 54.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

1-phenyl-2-(2,3,4,5-tetramethylphenyl)ethane-1,2-dithione
CID 18994072
1,3-dimethyl-4-(1-phenylethenyl)-2-prop-1-en-2-ylbenzene
CID 144558662
diphenylmethanone;2-hydroxy-2-phenyl-1-(2,3,4,5-tetramethylphenyl)ethanone
CID 175015307
4-methyl-3-(1-phenylethenyl)pyridine
CID 142303241
1-phenylethenylbenzene;hydrochloride
CID 70400725
potassium 1-phenylethenylbenzene
CID 19358731
mercury(1+);1-phenylethenylbenzene;chloride
CID 171374959
2-fluoro-4-methoxy-1-(1-phenylethenyl)benzene
CID 156698107
CID 174812823
CID 174812823
4,6-bis(2,3,4,5-tetramethylbenzoyl)benzene-1,3-dicarboxylic acid
CID 23586555
1,5-dimethoxy-2,4-bis[1-(4-phenylphenyl)ethenyl]benzene
CID 132542324
1,3-dimethyl-4-(1-phenylethenyl)-2-propylbenzene;prop-1-yne
CID 144558671

Frequently Asked Questions

What is the IUPAC name of 1,2,3,4-tetramethyl-5-(1-phenylethenyl)benzene?
The IUPAC name of 1,2,3,4-tetramethyl-5-(1-phenylethenyl)benzene (CID 4285324) is 1,2,3,4-tetramethyl-5-(1-phenylethenyl)benzene.
What is the SMILES notation for 1,2,3,4-tetramethyl-5-(1-phenylethenyl)benzene?
The canonical SMILES for 1,2,3,4-tetramethyl-5-(1-phenylethenyl)benzene is C=C(c1ccccc1)c1cc(C)c(C)c(C)c1C.
What is the InChIKey of 1,2,3,4-tetramethyl-5-(1-phenylethenyl)benzene?
The InChIKey is NHMKJHNWCPMTFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20/c1-12-11-18(15(4)14(3)13(12)2)16(5)17-9-7-6-8-10-17/h6-11H,5H2,1-4H3.
What are the key properties of 1,2,3,4-tetramethyl-5-(1-phenylethenyl)benzene?
1,2,3,4-tetramethyl-5-(1-phenylethenyl)benzene has a molecular weight of 236.36 g/mol, XLogP of 4.98, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2,3,4-tetramethyl-5-(1-phenylethenyl)benzene is sourced from PubChem (CID 4285324), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).