phenyl-[2-[(Z)-4-phenylbut-3-enyl]phenyl]methanone

C23H20O — CID 10519200

IUPACphenyl-[2-[(Z)-4-phenylbut-3-enyl]phenyl]methanone
SMILESO=C(c1ccccc1)c1ccccc1CC/C=C\c1ccccc1
InChIInChI=1S/C23H20O/c24-23(21-16-5-2-6-17-21)22-18-10-9-15-20(22)14-8-7-13-19-11-3-1-4-12-19/h1-7,9-13,15-18H,8,14H2/b13-7-
InChIKeyQZWXPGGJYMFZSN-QPEQYQDCSA-N
MW312.41 g/mol
LogP5.56
Rot. Bonds6

About phenyl-[2-[(Z)-4-phenylbut-3-enyl]phenyl]methanone

phenyl-[2-[(Z)-4-phenylbut-3-enyl]phenyl]methanone (PubChem CID 10519200) has the molecular formula C23H20O and a molecular weight of 312.41 g/mol. Its IUPAC name is phenyl-[2-[(Z)-4-phenylbut-3-enyl]phenyl]methanone.

Molecular Properties

Compound Namephenyl-[2-[(Z)-4-phenylbut-3-enyl]phenyl]methanone
PubChem CID10519200
Molecular FormulaC23H20O
Molecular Weight312.41 g/mol
Exact Mass312.15
IUPAC Namephenyl-[2-[(Z)-4-phenylbut-3-enyl]phenyl]methanone
SMILESO=C(c1ccccc1)c1ccccc1CC/C=C\c1ccccc1
InChIInChI=1S/C23H20O/c24-23(21-16-5-2-6-17-21)22-18-10-9-15-20(22)14-8-7-13-19-11-3-1-4-12-19/h1-7,9-13,15-18H,8,14H2/b13-7-
InChIKeyQZWXPGGJYMFZSN-QPEQYQDCSA-N
XLogP5.56
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500312.41
LogP ≤ 55.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

[2-(3-hydroxypropyl)phenyl]-phenylmethanone
CID 66892901
phenyl-(2-prop-2-enylphenyl)methanone
CID 12026554
phenyl-(2-tridecylphenyl)methanone
CID 159151783
[2-(10-chlorodecyl)phenyl]-phenylmethanone
CID 157301070
sodium;(2-ethylphenyl)-phenylmethanone;hydride
CID 175475173
2-(2-benzoylphenyl)acetyl chloride
CID 139777615
(E)-5-phenylpent-4-enoic acid
CID 5370650
(E)-1,7-diphenylhept-6-en-1-one
CID 5369755
6-[4-(2-acetylphenyl)but-1-enyl]-2,3-dihydroinden-1-one
CID 139329781
[2-(2,3-dihydroxypropyl)phenyl]-phenylmethanone
CID 174521590
diphenylmethanone;(E)-3-phenylprop-2-enoic acid
CID 70019468
[(E)-4-phenylbut-3-enyl]carbamic acid
CID 22018485

Frequently Asked Questions

What is the IUPAC name of phenyl-[2-[(Z)-4-phenylbut-3-enyl]phenyl]methanone?
The IUPAC name of phenyl-[2-[(Z)-4-phenylbut-3-enyl]phenyl]methanone (CID 10519200) is phenyl-[2-[(Z)-4-phenylbut-3-enyl]phenyl]methanone.
What is the SMILES notation for phenyl-[2-[(Z)-4-phenylbut-3-enyl]phenyl]methanone?
The canonical SMILES for phenyl-[2-[(Z)-4-phenylbut-3-enyl]phenyl]methanone is O=C(c1ccccc1)c1ccccc1CC/C=C\c1ccccc1.
What is the InChIKey of phenyl-[2-[(Z)-4-phenylbut-3-enyl]phenyl]methanone?
The InChIKey is QZWXPGGJYMFZSN-QPEQYQDCSA-N. The full InChI is InChI=1S/C23H20O/c24-23(21-16-5-2-6-17-21)22-18-10-9-15-20(22)14-8-7-13-19-11-3-1-4-12-19/h1-7,9-13,15-18H,8,14H2/b13-7-.
What are the key properties of phenyl-[2-[(Z)-4-phenylbut-3-enyl]phenyl]methanone?
phenyl-[2-[(Z)-4-phenylbut-3-enyl]phenyl]methanone has a molecular weight of 312.41 g/mol, XLogP of 5.56, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for phenyl-[2-[(Z)-4-phenylbut-3-enyl]phenyl]methanone is sourced from PubChem (CID 10519200), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).