(2,4,6-tributylphenyl)methanol

C19H32O — CID 21099541

IUPAC(2,4,6-tributylphenyl)methanol
SMILESCCCCc1cc(CCCC)c(CO)c(CCCC)c1
InChIInChI=1S/C19H32O/c1-4-7-10-16-13-17(11-8-5-2)19(15-20)18(14-16)12-9-6-3/h13-14,20H,4-12,15H2,1-3H3
InChIKeyPIOWGDJQUXMSIZ-UHFFFAOYSA-N
MW276.46 g/mol
LogP5.21
Rot. Bonds10

About (2,4,6-tributylphenyl)methanol

(2,4,6-tributylphenyl)methanol (PubChem CID 21099541) has the molecular formula C19H32O and a molecular weight of 276.46 g/mol. Its IUPAC name is (2,4,6-tributylphenyl)methanol.

Molecular Properties

Compound Name(2,4,6-tributylphenyl)methanol
PubChem CID21099541
Molecular FormulaC19H32O
Molecular Weight276.46 g/mol
Exact Mass276.25
IUPAC Name(2,4,6-tributylphenyl)methanol
SMILESCCCCc1cc(CCCC)c(CO)c(CCCC)c1
InChIInChI=1S/C19H32O/c1-4-7-10-16-13-17(11-8-5-2)19(15-20)18(14-16)12-9-6-3/h13-14,20H,4-12,15H2,1-3H3
InChIKeyPIOWGDJQUXMSIZ-UHFFFAOYSA-N
XLogP5.21
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds10
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500276.46
LogP ≤ 55.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1,2,5-tributyl-3-[2-(2,3,5-tributylphenyl)ethyl]benzene
CID 101311557
5-butyl-1,2,3-tridodecylbenzene
CID 91450595
3,5-dibutyl-2-[(2,4-dibutyl-6-hydroxyphenyl)methyl]phenol
CID 86052181
(4-butyl-2,6-dichlorophenyl)methanol
CID 66653370
2,4,6-tributylphenol;zirconium(2+);dichloride
CID 174692892
4-butyl-2,6-didodecylphenol
CID 66619638
3,5-dibutyl-2-methylphenol
CID 10285910
2-butyl-4-pentyl-6-propylphenol
CID 66878895
2,4,6-triheptylphenol
CID 139692303
2-butyl-6-ethyl-4-pentylphenol
CID 66879170
2-(aminomethyl)-4,6-dibutylphenol
CID 167065415
3,5-dibutylphenol
CID 15936149

Frequently Asked Questions

What is the IUPAC name of (2,4,6-tributylphenyl)methanol?
The IUPAC name of (2,4,6-tributylphenyl)methanol (CID 21099541) is (2,4,6-tributylphenyl)methanol.
What is the SMILES notation for (2,4,6-tributylphenyl)methanol?
The canonical SMILES for (2,4,6-tributylphenyl)methanol is CCCCc1cc(CCCC)c(CO)c(CCCC)c1.
What is the InChIKey of (2,4,6-tributylphenyl)methanol?
The InChIKey is PIOWGDJQUXMSIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H32O/c1-4-7-10-16-13-17(11-8-5-2)19(15-20)18(14-16)12-9-6-3/h13-14,20H,4-12,15H2,1-3H3.
What are the key properties of (2,4,6-tributylphenyl)methanol?
(2,4,6-tributylphenyl)methanol has a molecular weight of 276.46 g/mol, XLogP of 5.21, 10 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2,4,6-tributylphenyl)methanol is sourced from PubChem (CID 21099541), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).