4-(4-methylphenyl)-1,2-dipropylbenzene

C19H24 — CID 159068290

IUPAC4-(4-methylphenyl)-1,2-dipropylbenzene
SMILESCCCc1ccc(-c2ccc(C)cc2)cc1CCC
InChIInChI=1S/C19H24/c1-4-6-16-12-13-19(14-18(16)7-5-2)17-10-8-15(3)9-11-17/h8-14H,4-7H2,1-3H3
InChIKeyVOOXRRYVKDRFCR-UHFFFAOYSA-N
MW252.40 g/mol
LogP5.57
Rot. Bonds5

About 4-(4-methylphenyl)-1,2-dipropylbenzene

4-(4-methylphenyl)-1,2-dipropylbenzene (PubChem CID 159068290) has the molecular formula C19H24 and a molecular weight of 252.40 g/mol. Its IUPAC name is 4-(4-methylphenyl)-1,2-dipropylbenzene.

Molecular Properties

Compound Name4-(4-methylphenyl)-1,2-dipropylbenzene
PubChem CID159068290
Molecular FormulaC19H24
Molecular Weight252.40 g/mol
Exact Mass252.19
IUPAC Name4-(4-methylphenyl)-1,2-dipropylbenzene
SMILESCCCc1ccc(-c2ccc(C)cc2)cc1CCC
InChIInChI=1S/C19H24/c1-4-6-16-12-13-19(14-18(16)7-5-2)17-10-8-15(3)9-11-17/h8-14H,4-7H2,1-3H3
InChIKeyVOOXRRYVKDRFCR-UHFFFAOYSA-N
XLogP5.57
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500252.40
LogP ≤ 55.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 4-(4-methylphenyl)-1,2-dipropylbenzene?
The IUPAC name of 4-(4-methylphenyl)-1,2-dipropylbenzene (CID 159068290) is 4-(4-methylphenyl)-1,2-dipropylbenzene.
What is the SMILES notation for 4-(4-methylphenyl)-1,2-dipropylbenzene?
The canonical SMILES for 4-(4-methylphenyl)-1,2-dipropylbenzene is CCCc1ccc(-c2ccc(C)cc2)cc1CCC.
What is the InChIKey of 4-(4-methylphenyl)-1,2-dipropylbenzene?
The InChIKey is VOOXRRYVKDRFCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24/c1-4-6-16-12-13-19(14-18(16)7-5-2)17-10-8-15(3)9-11-17/h8-14H,4-7H2,1-3H3.
What are the key properties of 4-(4-methylphenyl)-1,2-dipropylbenzene?
4-(4-methylphenyl)-1,2-dipropylbenzene has a molecular weight of 252.40 g/mol, XLogP of 5.57, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-methylphenyl)-1,2-dipropylbenzene is sourced from PubChem (CID 159068290), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).