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

C29H32O6 — CID 67560880

IUPACformaldehyde;4-[2-(4-hydroxyphenyl)propan-2-yl]phenol;phenol
SMILESC=O.C=O.CC(C)(c1ccc(O)cc1)c1ccc(O)cc1.Oc1ccccc1.Oc1ccccc1
InChIInChI=1S/C15H16O2.2C6H6O.2CH2O/c1-15(2,11-3-7-13(16)8-4-11)12-5-9-14(17)10-6-12;2*7-6-4-2-1-3-5-6;2*1-2/h3-10,16-17H,1-2H3;2*1-5,7H;2*1H2
InChIKeyGLGXEHYVBUFFGF-UHFFFAOYSA-N
MW476.57 g/mol
LogP5.84
Rot. Bonds2

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

formaldehyde;4-[2-(4-hydroxyphenyl)propan-2-yl]phenol;phenol (PubChem CID 67560880) has the molecular formula C29H32O6 and a molecular weight of 476.57 g/mol. Its IUPAC name is formaldehyde;4-[2-(4-hydroxyphenyl)propan-2-yl]phenol;phenol.

Molecular Properties

Compound Nameformaldehyde;4-[2-(4-hydroxyphenyl)propan-2-yl]phenol;phenol
PubChem CID67560880
Molecular FormulaC29H32O6
Molecular Weight476.57 g/mol
Exact Mass476.22
IUPAC Nameformaldehyde;4-[2-(4-hydroxyphenyl)propan-2-yl]phenol;phenol
SMILESC=O.C=O.CC(C)(c1ccc(O)cc1)c1ccc(O)cc1.Oc1ccccc1.Oc1ccccc1
InChIInChI=1S/C15H16O2.2C6H6O.2CH2O/c1-15(2,11-3-7-13(16)8-4-11)12-5-9-14(17)10-6-12;2*7-6-4-2-1-3-5-6;2*1-2/h3-10,16-17H,1-2H3;2*1-5,7H;2*1H2
InChIKeyGLGXEHYVBUFFGF-UHFFFAOYSA-N
XLogP5.84
TPSA115.06 Ų
H-Bond Donors4
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms35
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500476.57
LogP ≤ 55.84
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 106

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Related Compounds

4-[2-[3,5-bis[2-(4-hydroxyphenyl)propan-2-yl]phenyl]propan-2-yl]phenol;phenol
CID 160835894
copper;tetrakis(4-(2-phenylpropan-2-yl)phenol)
CID 87921790
4-[2-[4-[2-(4-hydroxyphenyl)(1,3-13C2)propan-2-yl]phenyl](1,3-13C2)propan-2-yl]phenol
CID 139024042
biphenylene;4-[2-(4-hydroxyphenyl)propan-2-yl]phenol
CID 68577534
ethane;phenol;2-phenylpropan-2-ol;4-(2-phenylpropan-2-yl)phenol
CID 158640691
disodium bisphenol-A
CID 66941220
4-[2-(4-hydroxyphenyl)propan-2-yl]phenol;silver
CID 118588949
disodium;hydride;4-[2-(4-hydroxyphenyl)propan-2-yl]phenol
CID 173033429
carbanide;tetrakis(4-[2-(4-hydroxyphenyl)propan-2-yl]phenol);tantalum
CID 20695639
carbanide;4-[2-[4-[2-(4-hydroxyphenyl)propan-2-yl]phenyl]propan-2-yl]phenol;methanol;titanium
CID 20637487
4-[2-[4-[1,1-bis(4-hydroxyphenyl)ethyl]phenyl]propan-2-yl]phenol
CID 634278
benzene-1,3,5-triol;4-[2-(4-hydroxyphenyl)propan-2-yl]phenol
CID 159326359

Frequently Asked Questions

What is the IUPAC name of formaldehyde;4-[2-(4-hydroxyphenyl)propan-2-yl]phenol;phenol?
The IUPAC name of formaldehyde;4-[2-(4-hydroxyphenyl)propan-2-yl]phenol;phenol (CID 67560880) is formaldehyde;4-[2-(4-hydroxyphenyl)propan-2-yl]phenol;phenol.
What is the SMILES notation for formaldehyde;4-[2-(4-hydroxyphenyl)propan-2-yl]phenol;phenol?
The canonical SMILES for formaldehyde;4-[2-(4-hydroxyphenyl)propan-2-yl]phenol;phenol is C=O.C=O.CC(C)(c1ccc(O)cc1)c1ccc(O)cc1.Oc1ccccc1.Oc1ccccc1.
What is the InChIKey of formaldehyde;4-[2-(4-hydroxyphenyl)propan-2-yl]phenol;phenol?
The InChIKey is GLGXEHYVBUFFGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16O2.2C6H6O.2CH2O/c1-15(2,11-3-7-13(16)8-4-11)12-5-9-14(17)10-6-12;2*7-6-4-2-1-3-5-6;2*1-2/h3-10,16-17H,1-2H3;2*1-5,7H;2*1H2.
What are the key properties of formaldehyde;4-[2-(4-hydroxyphenyl)propan-2-yl]phenol;phenol?
formaldehyde;4-[2-(4-hydroxyphenyl)propan-2-yl]phenol;phenol has a molecular weight of 476.57 g/mol, XLogP of 5.84, 2 rotatable bonds, 4 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for formaldehyde;4-[2-(4-hydroxyphenyl)propan-2-yl]phenol;phenol is sourced from PubChem (CID 67560880), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).