1,2,4-tripropylbenzene

C15H24 — CID 600221

IUPAC1,2,4-tripropylbenzene
SMILESCCCc1ccc(CCC)c(CCC)c1
InChIInChI=1S/C15H24/c1-4-7-13-10-11-14(8-5-2)15(12-13)9-6-3/h10-12H,4-9H2,1-3H3
InChIKeyNQLVMGZUKRNRQB-UHFFFAOYSA-N
MW204.36 g/mol
LogP4.54
Rot. Bonds6

About 1,2,4-tripropylbenzene

1,2,4-tripropylbenzene (PubChem CID 600221) has the molecular formula C15H24 and a molecular weight of 204.36 g/mol. Its IUPAC name is 1,2,4-tripropylbenzene.

Molecular Properties

Compound Name1,2,4-tripropylbenzene
PubChem CID600221
Molecular FormulaC15H24
Molecular Weight204.36 g/mol
Exact Mass204.19
IUPAC Name1,2,4-tripropylbenzene
SMILESCCCc1ccc(CCC)c(CCC)c1
InChIInChI=1S/C15H24/c1-4-7-13-10-11-14(8-5-2)15(12-13)9-6-3/h10-12H,4-9H2,1-3H3
InChIKeyNQLVMGZUKRNRQB-UHFFFAOYSA-N
XLogP4.54
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.36
LogP ≤ 54.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 1,2,4-tripropylbenzene?
The IUPAC name of 1,2,4-tripropylbenzene (CID 600221) is 1,2,4-tripropylbenzene.
What is the SMILES notation for 1,2,4-tripropylbenzene?
The canonical SMILES for 1,2,4-tripropylbenzene is CCCc1ccc(CCC)c(CCC)c1.
What is the InChIKey of 1,2,4-tripropylbenzene?
The InChIKey is NQLVMGZUKRNRQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24/c1-4-7-13-10-11-14(8-5-2)15(12-13)9-6-3/h10-12H,4-9H2,1-3H3.
What are the key properties of 1,2,4-tripropylbenzene?
1,2,4-tripropylbenzene has a molecular weight of 204.36 g/mol, XLogP of 4.54, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2,4-tripropylbenzene is sourced from PubChem (CID 600221), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).