2-(7-bicyclo[4.2.0]octa-1,3,5-trienylmethoxy)phenol

C15H14O2 — CID 66417200

IUPAC2-(7-bicyclo[4.2.0]octa-1,3,5-trienylmethoxy)phenol
SMILESOc1ccccc1OCC1Cc2ccccc21
InChIInChI=1S/C15H14O2/c16-14-7-3-4-8-15(14)17-10-12-9-11-5-1-2-6-13(11)12/h1-8,12,16H,9-10H2
InChIKeySWGPUTWLYRWMIA-UHFFFAOYSA-N
MW226.28 g/mol
LogP3.11
Rot. Bonds3

About 2-(7-bicyclo[4.2.0]octa-1,3,5-trienylmethoxy)phenol

2-(7-bicyclo[4.2.0]octa-1,3,5-trienylmethoxy)phenol (PubChem CID 66417200) has the molecular formula C15H14O2 and a molecular weight of 226.28 g/mol. Its IUPAC name is 2-(7-bicyclo[4.2.0]octa-1,3,5-trienylmethoxy)phenol.

Molecular Properties

Compound Name2-(7-bicyclo[4.2.0]octa-1,3,5-trienylmethoxy)phenol
PubChem CID66417200
Molecular FormulaC15H14O2
Molecular Weight226.28 g/mol
Exact Mass226.10
IUPAC Name2-(7-bicyclo[4.2.0]octa-1,3,5-trienylmethoxy)phenol
SMILESOc1ccccc1OCC1Cc2ccccc21
InChIInChI=1S/C15H14O2/c16-14-7-3-4-8-15(14)17-10-12-9-11-5-1-2-6-13(11)12/h1-8,12,16H,9-10H2
InChIKeySWGPUTWLYRWMIA-UHFFFAOYSA-N
XLogP3.11
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.28
LogP ≤ 53.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-(7-bicyclo[4.2.0]octa-1,3,5-trienylmethoxy)-2,3-dihydro-1H-inden-1-ol
CID 66419924
N-[4-(7-bicyclo[4.2.0]octa-1,3,5-trienylmethoxy)-2,3-dihydroinden-1-ylidene]hydroxylamine
CID 77133271
2-(3,4-dihydro-2H-chromen-4-ylmethoxy)phenol
CID 104768812
1-[2-(7-bicyclo[4.2.0]octa-1,3,5-trienylmethoxy)phenyl]butan-2-amine
CID 66394674
7-[(2-bromo-4-methylphenoxy)methyl]bicyclo[4.2.0]octa-1,3,5-triene
CID 66419117
3-(7-bicyclo[4.2.0]octa-1,3,5-trienylmethoxy)-4-methoxybenzoic acid
CID 66418341
2-[2-(7-bicyclo[4.2.0]octa-1,3,5-trienylmethoxy)-5-bromophenyl]ethanamine
CID 66397004
7-[(2-bromo-4-methoxyphenoxy)methyl]bicyclo[4.2.0]octa-1,3,5-triene
CID 104707526
2-(7-bicyclo[4.2.0]octa-1,3,5-trienylmethoxy)-5-bromobenzenecarbothioamide
CID 83145829
1-[2-(7-bicyclo[4.2.0]octa-1,3,5-trienylmethoxy)-4-methoxyphenyl]ethanone
CID 82003693
7-[[4-(chloromethyl)-2-methoxyphenoxy]methyl]bicyclo[4.2.0]octa-1,3,5-triene
CID 66417199
7-[(2-methyl-5-propan-2-ylphenoxy)methyl]bicyclo[4.2.0]octa-1,3,5-triene
CID 81005539

Frequently Asked Questions

What is the IUPAC name of 2-(7-bicyclo[4.2.0]octa-1,3,5-trienylmethoxy)phenol?
The IUPAC name of 2-(7-bicyclo[4.2.0]octa-1,3,5-trienylmethoxy)phenol (CID 66417200) is 2-(7-bicyclo[4.2.0]octa-1,3,5-trienylmethoxy)phenol.
What is the SMILES notation for 2-(7-bicyclo[4.2.0]octa-1,3,5-trienylmethoxy)phenol?
The canonical SMILES for 2-(7-bicyclo[4.2.0]octa-1,3,5-trienylmethoxy)phenol is Oc1ccccc1OCC1Cc2ccccc21.
What is the InChIKey of 2-(7-bicyclo[4.2.0]octa-1,3,5-trienylmethoxy)phenol?
The InChIKey is SWGPUTWLYRWMIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14O2/c16-14-7-3-4-8-15(14)17-10-12-9-11-5-1-2-6-13(11)12/h1-8,12,16H,9-10H2.
What are the key properties of 2-(7-bicyclo[4.2.0]octa-1,3,5-trienylmethoxy)phenol?
2-(7-bicyclo[4.2.0]octa-1,3,5-trienylmethoxy)phenol has a molecular weight of 226.28 g/mol, XLogP of 3.11, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(7-bicyclo[4.2.0]octa-1,3,5-trienylmethoxy)phenol is sourced from PubChem (CID 66417200), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).