4-methyl-2-(2-phenylethenyl)benzene-1,3-diol

C15H14O2 — CID 135318520

IUPAC4-methyl-2-(2-phenylethenyl)benzene-1,3-diol
SMILESCc1ccc(O)c(C=Cc2ccccc2)c1O
InChIInChI=1S/C15H14O2/c1-11-7-10-14(16)13(15(11)17)9-8-12-5-3-2-4-6-12/h2-10,16-17H,1H3
InChIKeyYVVVFDBJCDNGKD-UHFFFAOYSA-N
MW226.28 g/mol
LogP3.58
Rot. Bonds2

About 4-methyl-2-(2-phenylethenyl)benzene-1,3-diol

4-methyl-2-(2-phenylethenyl)benzene-1,3-diol (PubChem CID 135318520) has the molecular formula C15H14O2 and a molecular weight of 226.28 g/mol. Its IUPAC name is 4-methyl-2-(2-phenylethenyl)benzene-1,3-diol.

Molecular Properties

Compound Name4-methyl-2-(2-phenylethenyl)benzene-1,3-diol
PubChem CID135318520
Molecular FormulaC15H14O2
Molecular Weight226.28 g/mol
Exact Mass226.10
IUPAC Name4-methyl-2-(2-phenylethenyl)benzene-1,3-diol
SMILESCc1ccc(O)c(C=Cc2ccccc2)c1O
InChIInChI=1S/C15H14O2/c1-11-7-10-14(16)13(15(11)17)9-8-12-5-3-2-4-6-12/h2-10,16-17H,1H3
InChIKeyYVVVFDBJCDNGKD-UHFFFAOYSA-N
XLogP3.58
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.28
LogP ≤ 53.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

6-methyl-2,3-bis(2-phenylethenyl)phenol
CID 54059537
2-methyl-6-[(E)-2-phenylethenyl]phenol
CID 22713146
CID 172791684
CID 172791684
3-[2,4-dihydroxy-3-(2-phenylethenyl)phenyl]-2-methylpropanal
CID 87902751
2-methyl-5-(2-phenylethenyl)benzene-1,3-diol
CID 68629496
2-(2-phenylethenyl)-3-prop-1-en-2-ylphenol
CID 70429163
3-hydroxy-4-(2-phenylethenyl)cyclobut-3-ene-1,2-dione
CID 91203784
3-[2-(3-hydroxyphenyl)ethenyl]benzene-1,2,4-triol
CID 173498744
2-methyl-4,6-bis[(E)-2-phenylethenyl]phenol
CID 6071425
but-2-enedioic acid;2,3,4-tris(2-phenylethenyl)phenol
CID 159401430
CID 70567885
CID 70567885
CID 70569152
CID 70569152

Frequently Asked Questions

What is the IUPAC name of 4-methyl-2-(2-phenylethenyl)benzene-1,3-diol?
The IUPAC name of 4-methyl-2-(2-phenylethenyl)benzene-1,3-diol (CID 135318520) is 4-methyl-2-(2-phenylethenyl)benzene-1,3-diol.
What is the SMILES notation for 4-methyl-2-(2-phenylethenyl)benzene-1,3-diol?
The canonical SMILES for 4-methyl-2-(2-phenylethenyl)benzene-1,3-diol is Cc1ccc(O)c(C=Cc2ccccc2)c1O.
What is the InChIKey of 4-methyl-2-(2-phenylethenyl)benzene-1,3-diol?
The InChIKey is YVVVFDBJCDNGKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14O2/c1-11-7-10-14(16)13(15(11)17)9-8-12-5-3-2-4-6-12/h2-10,16-17H,1H3.
What are the key properties of 4-methyl-2-(2-phenylethenyl)benzene-1,3-diol?
4-methyl-2-(2-phenylethenyl)benzene-1,3-diol has a molecular weight of 226.28 g/mol, XLogP of 3.58, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-2-(2-phenylethenyl)benzene-1,3-diol is sourced from PubChem (CID 135318520), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).