4-[2-(4-hydroxyphenyl)propan-2-yl]phenol;bis(2-methylpropane)

C23H36O2 — CID 143736977

IUPAC4-[2-(4-hydroxyphenyl)propan-2-yl]phenol;bis(2-methylpropane)
SMILESCC(C)(c1ccc(O)cc1)c1ccc(O)cc1.CC(C)C.CC(C)C
InChIInChI=1S/C15H16O2.2C4H10/c1-15(2,11-3-7-13(16)8-4-11)12-5-9-14(17)10-6-12;2*1-4(2)3/h3-10,16-17H,1-2H3;2*4H,1-3H3
InChIKeyJIODYNPXTWVPGC-UHFFFAOYSA-N
MW344.54 g/mol
LogP6.75
Rot. Bonds2

About 4-[2-(4-hydroxyphenyl)propan-2-yl]phenol;bis(2-methylpropane)

4-[2-(4-hydroxyphenyl)propan-2-yl]phenol;bis(2-methylpropane) (PubChem CID 143736977) has the molecular formula C23H36O2 and a molecular weight of 344.54 g/mol. Its IUPAC name is 4-[2-(4-hydroxyphenyl)propan-2-yl]phenol;bis(2-methylpropane).

Molecular Properties

Compound Name4-[2-(4-hydroxyphenyl)propan-2-yl]phenol;bis(2-methylpropane)
PubChem CID143736977
Molecular FormulaC23H36O2
Molecular Weight344.54 g/mol
Exact Mass344.27
IUPAC Name4-[2-(4-hydroxyphenyl)propan-2-yl]phenol;bis(2-methylpropane)
SMILESCC(C)(c1ccc(O)cc1)c1ccc(O)cc1.CC(C)C.CC(C)C
InChIInChI=1S/C15H16O2.2C4H10/c1-15(2,11-3-7-13(16)8-4-11)12-5-9-14(17)10-6-12;2*1-4(2)3/h3-10,16-17H,1-2H3;2*4H,1-3H3
InChIKeyJIODYNPXTWVPGC-UHFFFAOYSA-N
XLogP6.75
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500344.54
LogP ≤ 56.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

4-tert-Pentylphenol
CID 6643
Diethylstilbestrol
CID 448537
Bisphenol A
CID 6623
2,6-Di-tert-butyl-4-methylphenol
CID 31404
Dienestrol
CID 667476
(1,1'-Biphenyl)-2-ol
CID 7017
4-tert-Butylphenol
CID 7393
4-tert-Butylcatechol
CID 7381
Magnolol
CID 72300
Hexestrol
CID 192197
4-Nonylphenol
CID 1752
2,4-Di-tert-butylphenol
CID 7311

Frequently Asked Questions

What is the IUPAC name of 4-[2-(4-hydroxyphenyl)propan-2-yl]phenol;bis(2-methylpropane)?
The IUPAC name of 4-[2-(4-hydroxyphenyl)propan-2-yl]phenol;bis(2-methylpropane) (CID 143736977) is 4-[2-(4-hydroxyphenyl)propan-2-yl]phenol;bis(2-methylpropane).
What is the SMILES notation for 4-[2-(4-hydroxyphenyl)propan-2-yl]phenol;bis(2-methylpropane)?
The canonical SMILES for 4-[2-(4-hydroxyphenyl)propan-2-yl]phenol;bis(2-methylpropane) is CC(C)(c1ccc(O)cc1)c1ccc(O)cc1.CC(C)C.CC(C)C.
What is the InChIKey of 4-[2-(4-hydroxyphenyl)propan-2-yl]phenol;bis(2-methylpropane)?
The InChIKey is JIODYNPXTWVPGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16O2.2C4H10/c1-15(2,11-3-7-13(16)8-4-11)12-5-9-14(17)10-6-12;2*1-4(2)3/h3-10,16-17H,1-2H3;2*4H,1-3H3.
What are the key properties of 4-[2-(4-hydroxyphenyl)propan-2-yl]phenol;bis(2-methylpropane)?
4-[2-(4-hydroxyphenyl)propan-2-yl]phenol;bis(2-methylpropane) has a molecular weight of 344.54 g/mol, XLogP of 6.75, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(4-hydroxyphenyl)propan-2-yl]phenol;bis(2-methylpropane) is sourced from PubChem (CID 143736977), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).