1,2,3,4,5,6-hexamethyl-7-propylnaphthalene

C19H26 — CID 59872941

IUPAC1,2,3,4,5,6-hexamethyl-7-propylnaphthalene
SMILESCCCc1cc2c(C)c(C)c(C)c(C)c2c(C)c1C
InChIInChI=1S/C19H26/c1-8-9-17-10-18-14(5)11(2)12(3)15(6)19(18)16(7)13(17)4/h10H,8-9H2,1-7H3
InChIKeyPZGKOGXFDFCSBZ-UHFFFAOYSA-N
MW254.42 g/mol
LogP5.64
Rot. Bonds2

About 1,2,3,4,5,6-hexamethyl-7-propylnaphthalene

1,2,3,4,5,6-hexamethyl-7-propylnaphthalene (PubChem CID 59872941) has the molecular formula C19H26 and a molecular weight of 254.42 g/mol. Its IUPAC name is 1,2,3,4,5,6-hexamethyl-7-propylnaphthalene.

Molecular Properties

Compound Name1,2,3,4,5,6-hexamethyl-7-propylnaphthalene
PubChem CID59872941
Molecular FormulaC19H26
Molecular Weight254.42 g/mol
Exact Mass254.20
IUPAC Name1,2,3,4,5,6-hexamethyl-7-propylnaphthalene
SMILESCCCc1cc2c(C)c(C)c(C)c(C)c2c(C)c1C
InChIInChI=1S/C19H26/c1-8-9-17-10-18-14(5)11(2)12(3)15(6)19(18)16(7)13(17)4/h10H,8-9H2,1-7H3
InChIKeyPZGKOGXFDFCSBZ-UHFFFAOYSA-N
XLogP5.64
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500254.42
LogP ≤ 55.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 1,2,3,4,5,6-hexamethyl-7-propylnaphthalene?
The IUPAC name of 1,2,3,4,5,6-hexamethyl-7-propylnaphthalene (CID 59872941) is 1,2,3,4,5,6-hexamethyl-7-propylnaphthalene.
What is the SMILES notation for 1,2,3,4,5,6-hexamethyl-7-propylnaphthalene?
The canonical SMILES for 1,2,3,4,5,6-hexamethyl-7-propylnaphthalene is CCCc1cc2c(C)c(C)c(C)c(C)c2c(C)c1C.
What is the InChIKey of 1,2,3,4,5,6-hexamethyl-7-propylnaphthalene?
The InChIKey is PZGKOGXFDFCSBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26/c1-8-9-17-10-18-14(5)11(2)12(3)15(6)19(18)16(7)13(17)4/h10H,8-9H2,1-7H3.
What are the key properties of 1,2,3,4,5,6-hexamethyl-7-propylnaphthalene?
1,2,3,4,5,6-hexamethyl-7-propylnaphthalene has a molecular weight of 254.42 g/mol, XLogP of 5.64, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2,3,4,5,6-hexamethyl-7-propylnaphthalene is sourced from PubChem (CID 59872941), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).