1-[2-[(E)-2-phenylethenyl]phenyl]propan-2-ol

C17H18O — CID 158078399

IUPAC1-[2-[(E)-2-phenylethenyl]phenyl]propan-2-ol
SMILESCC(O)Cc1ccccc1/C=C/c1ccccc1
InChIInChI=1S/C17H18O/c1-14(18)13-17-10-6-5-9-16(17)12-11-15-7-3-2-4-8-15/h2-12,14,18H,13H2,1H3/b12-11+
InChIKeyFMQNJOBDMJCXNN-VAWYXSNFSA-N
MW238.33 g/mol
LogP3.78
Rot. Bonds4

About 1-[2-[(E)-2-phenylethenyl]phenyl]propan-2-ol

1-[2-[(E)-2-phenylethenyl]phenyl]propan-2-ol (PubChem CID 158078399) has the molecular formula C17H18O and a molecular weight of 238.33 g/mol. Its IUPAC name is 1-[2-[(E)-2-phenylethenyl]phenyl]propan-2-ol.

Molecular Properties

Compound Name1-[2-[(E)-2-phenylethenyl]phenyl]propan-2-ol
PubChem CID158078399
Molecular FormulaC17H18O
Molecular Weight238.33 g/mol
Exact Mass238.14
IUPAC Name1-[2-[(E)-2-phenylethenyl]phenyl]propan-2-ol
SMILESCC(O)Cc1ccccc1/C=C/c1ccccc1
InChIInChI=1S/C17H18O/c1-14(18)13-17-10-6-5-9-16(17)12-11-15-7-3-2-4-8-15/h2-12,14,18H,13H2,1H3/b12-11+
InChIKeyFMQNJOBDMJCXNN-VAWYXSNFSA-N
XLogP3.78
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.33
LogP ≤ 53.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'stilbene', 'substructure': 'N/A'}

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Related Compounds

1-ethyl-2-[(Z)-2-phenylethenyl]benzene
CID 142017215
[2-[(E)-2-phenylethenyl]phenyl]methanediol
CID 23212079
2-[2-(2-hydroxypropyl)phenyl]acetic acid
CID 117111520
1-[2-[(E)-2-phenylethenyl]phenyl]pentan-3-one
CID 102380406
1-nonyl-2-(2-phenylethenyl)benzene
CID 91593587
bis(1,2-bis[(E)-2-phenylethenyl]benzene);sulfane
CID 68618408
propane-1,2-diol;prop-1-enylbenzene
CID 161072622
1-[2-(2-phenylethenyl)phenyl]butane-2,2-diamine
CID 174680180
2-[[[2-hydroxy-3-(2-hydroxypropyl)phenyl]methylidenehydrazinylidene]methyl]-6-(2-hydroxypropyl)phenol
CID 136651800
1-(3-phenylprop-2-enoxy)propan-2-ol
CID 70377991
N,N-dimethylmethanamine;stilbene
CID 174368184
(Z,2R)-4-phenylbut-3-en-2-ol
CID 11457765

Frequently Asked Questions

What is the IUPAC name of 1-[2-[(E)-2-phenylethenyl]phenyl]propan-2-ol?
The IUPAC name of 1-[2-[(E)-2-phenylethenyl]phenyl]propan-2-ol (CID 158078399) is 1-[2-[(E)-2-phenylethenyl]phenyl]propan-2-ol.
What is the SMILES notation for 1-[2-[(E)-2-phenylethenyl]phenyl]propan-2-ol?
The canonical SMILES for 1-[2-[(E)-2-phenylethenyl]phenyl]propan-2-ol is CC(O)Cc1ccccc1/C=C/c1ccccc1.
What is the InChIKey of 1-[2-[(E)-2-phenylethenyl]phenyl]propan-2-ol?
The InChIKey is FMQNJOBDMJCXNN-VAWYXSNFSA-N. The full InChI is InChI=1S/C17H18O/c1-14(18)13-17-10-6-5-9-16(17)12-11-15-7-3-2-4-8-15/h2-12,14,18H,13H2,1H3/b12-11+.
What are the key properties of 1-[2-[(E)-2-phenylethenyl]phenyl]propan-2-ol?
1-[2-[(E)-2-phenylethenyl]phenyl]propan-2-ol has a molecular weight of 238.33 g/mol, XLogP of 3.78, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[(E)-2-phenylethenyl]phenyl]propan-2-ol is sourced from PubChem (CID 158078399), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).