1,2,4-trimethyl-7-phenylnaphthalene

C19H18 — CID 166008458

IUPAC1,2,4-trimethyl-7-phenylnaphthalene
SMILESCc1cc(C)c2ccc(-c3ccccc3)cc2c1C
InChIInChI=1S/C19H18/c1-13-11-14(2)18-10-9-17(12-19(18)15(13)3)16-7-5-4-6-8-16/h4-12H,1-3H3
InChIKeyFDORYIYLKOTDOM-UHFFFAOYSA-N
MW246.35 g/mol
LogP5.43
Rot. Bonds1

About 1,2,4-trimethyl-7-phenylnaphthalene

1,2,4-trimethyl-7-phenylnaphthalene (PubChem CID 166008458) has the molecular formula C19H18 and a molecular weight of 246.35 g/mol. Its IUPAC name is 1,2,4-trimethyl-7-phenylnaphthalene.

Molecular Properties

Compound Name1,2,4-trimethyl-7-phenylnaphthalene
PubChem CID166008458
Molecular FormulaC19H18
Molecular Weight246.35 g/mol
Exact Mass246.14
IUPAC Name1,2,4-trimethyl-7-phenylnaphthalene
SMILESCc1cc(C)c2ccc(-c3ccccc3)cc2c1C
InChIInChI=1S/C19H18/c1-13-11-14(2)18-10-9-17(12-19(18)15(13)3)16-7-5-4-6-8-16/h4-12H,1-3H3
InChIKeyFDORYIYLKOTDOM-UHFFFAOYSA-N
XLogP5.43
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500246.35
LogP ≤ 55.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

1,5-dimethyl-3-phenylnaphthalene
CID 171720915
2-[4-[9,10-bis(2,3,4,5,6-pentamethylphenyl)anthracen-2-yl]phenyl]-9,10-bis(2,3,4,5,6-pentamethylphenyl)anthracene
CID 21043365
10-methyl-N,N,2,6-tetraphenylanthracen-9-amine
CID 89284135
7-chloro-1,2-dimethyl-4-phenylnaphthalene
CID 102481618
2,6,9,10-tetraphenylanthracene
CID 58645118
2,6,9,10-tetrakis(4-phenylphenyl)anthracene
CID 123923188
2-[3,5-bis(3,5-diphenylphenyl)phenyl]triphenylene
CID 167425355
2-phenyl-7-(3-phenylphenyl)triphenylene
CID 140787387
2-[2-methyl-4-[3-[3-(4-phenylphenyl)phenyl]phenyl]phenyl]triphenylene
CID 123442810
2-[3-[3-(3-phenylphenyl)phenyl]-5-[3-(4-phenylphenyl)phenyl]phenyl]triphenylene
CID 167425257
1,2,3,5-tetramethyl-4-phenylbenzene
CID 14973977
1,2,5-trimethyl-3,4-diphenylbenzene
CID 19420158

Frequently Asked Questions

What is the IUPAC name of 1,2,4-trimethyl-7-phenylnaphthalene?
The IUPAC name of 1,2,4-trimethyl-7-phenylnaphthalene (CID 166008458) is 1,2,4-trimethyl-7-phenylnaphthalene.
What is the SMILES notation for 1,2,4-trimethyl-7-phenylnaphthalene?
The canonical SMILES for 1,2,4-trimethyl-7-phenylnaphthalene is Cc1cc(C)c2ccc(-c3ccccc3)cc2c1C.
What is the InChIKey of 1,2,4-trimethyl-7-phenylnaphthalene?
The InChIKey is FDORYIYLKOTDOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18/c1-13-11-14(2)18-10-9-17(12-19(18)15(13)3)16-7-5-4-6-8-16/h4-12H,1-3H3.
What are the key properties of 1,2,4-trimethyl-7-phenylnaphthalene?
1,2,4-trimethyl-7-phenylnaphthalene has a molecular weight of 246.35 g/mol, XLogP of 5.43, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2,4-trimethyl-7-phenylnaphthalene is sourced from PubChem (CID 166008458), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).