4-methyl-1,2-dihydronaphthalene

C11H12 — CID 582327

IUPAC4-methyl-1,2-dihydronaphthalene
SMILESCC1=CCCc2ccccc21
InChIInChI=1S/C11H12/c1-9-5-4-7-10-6-2-3-8-11(9)10/h2-3,5-6,8H,4,7H2,1H3
InChIKeyNACZXFJTTCJDJR-UHFFFAOYSA-N
MW144.22 g/mol
LogP3.04
Rot. Bonds

About 4-methyl-1,2-dihydronaphthalene

4-methyl-1,2-dihydronaphthalene (PubChem CID 582327) has the molecular formula C11H12 and a molecular weight of 144.22 g/mol. Its IUPAC name is 4-methyl-1,2-dihydronaphthalene.

Molecular Properties

Compound Name4-methyl-1,2-dihydronaphthalene
PubChem CID582327
Molecular FormulaC11H12
Molecular Weight144.22 g/mol
Exact Mass144.09
IUPAC Name4-methyl-1,2-dihydronaphthalene
SMILESCC1=CCCc2ccccc21
InChIInChI=1S/C11H12/c1-9-5-4-7-10-6-2-3-8-11(9)10/h2-3,5-6,8H,4,7H2,1H3
InChIKeyNACZXFJTTCJDJR-UHFFFAOYSA-N
XLogP3.04
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.22
LogP ≤ 53.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-1,2-dihydronaphthalene?
The IUPAC name of 4-methyl-1,2-dihydronaphthalene (CID 582327) is 4-methyl-1,2-dihydronaphthalene.
What is the SMILES notation for 4-methyl-1,2-dihydronaphthalene?
The canonical SMILES for 4-methyl-1,2-dihydronaphthalene is CC1=CCCc2ccccc21.
What is the InChIKey of 4-methyl-1,2-dihydronaphthalene?
The InChIKey is NACZXFJTTCJDJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12/c1-9-5-4-7-10-6-2-3-8-11(9)10/h2-3,5-6,8H,4,7H2,1H3.
What are the key properties of 4-methyl-1,2-dihydronaphthalene?
4-methyl-1,2-dihydronaphthalene has a molecular weight of 144.22 g/mol, XLogP of 3.04, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-1,2-dihydronaphthalene is sourced from PubChem (CID 582327), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).