4-[(Z)-1,2-diphenylbut-2-enyl]phenol

C22H20O — CID 70549911

IUPAC4-[(Z)-1,2-diphenylbut-2-enyl]phenol
SMILESC/C=C(\c1ccccc1)C(c1ccccc1)c1ccc(O)cc1
InChIInChI=1S/C22H20O/c1-2-21(17-9-5-3-6-10-17)22(18-11-7-4-8-12-18)19-13-15-20(23)16-14-19/h2-16,22-23H,1H3/b21-2+
InChIKeyAACAWZWINYSZIP-WKOHNKLBSA-N
MW300.40 g/mol
LogP5.63
Rot. Bonds4

About 4-[(Z)-1,2-diphenylbut-2-enyl]phenol

4-[(Z)-1,2-diphenylbut-2-enyl]phenol (PubChem CID 70549911) has the molecular formula C22H20O and a molecular weight of 300.40 g/mol. Its IUPAC name is 4-[(Z)-1,2-diphenylbut-2-enyl]phenol.

Molecular Properties

Compound Name4-[(Z)-1,2-diphenylbut-2-enyl]phenol
PubChem CID70549911
Molecular FormulaC22H20O
Molecular Weight300.40 g/mol
Exact Mass300.15
IUPAC Name4-[(Z)-1,2-diphenylbut-2-enyl]phenol
SMILESC/C=C(\c1ccccc1)C(c1ccccc1)c1ccc(O)cc1
InChIInChI=1S/C22H20O/c1-2-21(17-9-5-3-6-10-17)22(18-11-7-4-8-12-18)19-13-15-20(23)16-14-19/h2-16,22-23H,1H3/b21-2+
InChIKeyAACAWZWINYSZIP-WKOHNKLBSA-N
XLogP5.63
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500300.40
LogP ≤ 55.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

4-[4-[1-(4-hydroxyphenyl)-2-phenylbut-2-enyl]phenoxy]butanoic acid
CID 90901535
(E,1R)-1,2-diphenylbut-2-en-1-ol
CID 135000774
bis(4-[3-(4-hydroxyphenyl)butan-2-yl]phenol);phenol
CID 161418686
[(E)-4-methylhex-2-en-3-yl]benzene
CID 12531537
1,3-diphenyl-2-[(Z)-1-phenylprop-1-enyl]propane-1,3-dione
CID 102162472
N-[(4-hydroxyphenyl)-phenylmethyl]benzamide
CID 135070955
ethane;[(E)-4-methylhex-2-en-3-yl]benzene
CID 167452677
argon;phenol
CID 159678450
benzene;phenol;prop-1-ene
CID 174830652
(Z)-4,4-difluoro-1,3-diphenylbut-2-en-1-ol
CID 102212500
4-(1-amino-2-phenylpropyl)phenol;hydrochloride
CID 67712087
[(E)-4-phenyl-1-tri(propan-2-yl)silylhex-4-en-1-yn-3-yl] 2,2-diphenylacetate
CID 102346407

Frequently Asked Questions

What is the IUPAC name of 4-[(Z)-1,2-diphenylbut-2-enyl]phenol?
The IUPAC name of 4-[(Z)-1,2-diphenylbut-2-enyl]phenol (CID 70549911) is 4-[(Z)-1,2-diphenylbut-2-enyl]phenol.
What is the SMILES notation for 4-[(Z)-1,2-diphenylbut-2-enyl]phenol?
The canonical SMILES for 4-[(Z)-1,2-diphenylbut-2-enyl]phenol is C/C=C(\c1ccccc1)C(c1ccccc1)c1ccc(O)cc1.
What is the InChIKey of 4-[(Z)-1,2-diphenylbut-2-enyl]phenol?
The InChIKey is AACAWZWINYSZIP-WKOHNKLBSA-N. The full InChI is InChI=1S/C22H20O/c1-2-21(17-9-5-3-6-10-17)22(18-11-7-4-8-12-18)19-13-15-20(23)16-14-19/h2-16,22-23H,1H3/b21-2+.
What are the key properties of 4-[(Z)-1,2-diphenylbut-2-enyl]phenol?
4-[(Z)-1,2-diphenylbut-2-enyl]phenol has a molecular weight of 300.40 g/mol, XLogP of 5.63, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(Z)-1,2-diphenylbut-2-enyl]phenol is sourced from PubChem (CID 70549911), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).