2,3-dibutyl-6-methylphenol;manganese

C15H24MnO — CID 174911131

IUPAC2,3-dibutyl-6-methylphenol;manganese
SMILESCCCCc1ccc(C)c(O)c1CCCC.[Mn]
InChIInChI=1S/C15H24O.Mn/c1-4-6-8-13-11-10-12(3)15(16)14(13)9-7-5-2;/h10-11,16H,4-9H2,1-3H3;
InChIKeyZEAWZKWWWRCSGH-UHFFFAOYSA-N
MW275.29 g/mol
LogP4.38
Rot. Bonds6

About 2,3-dibutyl-6-methylphenol;manganese

2,3-dibutyl-6-methylphenol;manganese (PubChem CID 174911131) has the molecular formula C15H24MnO and a molecular weight of 275.29 g/mol. Its IUPAC name is 2,3-dibutyl-6-methylphenol;manganese.

Molecular Properties

Compound Name2,3-dibutyl-6-methylphenol;manganese
PubChem CID174911131
Molecular FormulaC15H24MnO
Molecular Weight275.29 g/mol
Exact Mass275.12
IUPAC Name2,3-dibutyl-6-methylphenol;manganese
SMILESCCCCc1ccc(C)c(O)c1CCCC.[Mn]
InChIInChI=1S/C15H24O.Mn/c1-4-6-8-13-11-10-12(3)15(16)14(13)9-7-5-2;/h10-11,16H,4-9H2,1-3H3;
InChIKeyZEAWZKWWWRCSGH-UHFFFAOYSA-N
XLogP4.38
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.29
LogP ≤ 54.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2,3-dibutyl-6-methylphenol;manganese?
The IUPAC name of 2,3-dibutyl-6-methylphenol;manganese (CID 174911131) is 2,3-dibutyl-6-methylphenol;manganese.
What is the SMILES notation for 2,3-dibutyl-6-methylphenol;manganese?
The canonical SMILES for 2,3-dibutyl-6-methylphenol;manganese is CCCCc1ccc(C)c(O)c1CCCC.[Mn].
What is the InChIKey of 2,3-dibutyl-6-methylphenol;manganese?
The InChIKey is ZEAWZKWWWRCSGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24O.Mn/c1-4-6-8-13-11-10-12(3)15(16)14(13)9-7-5-2;/h10-11,16H,4-9H2,1-3H3;.
What are the key properties of 2,3-dibutyl-6-methylphenol;manganese?
2,3-dibutyl-6-methylphenol;manganese has a molecular weight of 275.29 g/mol, XLogP of 4.38, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dibutyl-6-methylphenol;manganese is sourced from PubChem (CID 174911131), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).