4-phenylmethoxy-1H-indene

C16H14O — CID 118181545

IUPAC4-phenylmethoxy-1H-indene
SMILESC1=Cc2c(cccc2OCc2ccccc2)C1
InChIInChI=1S/C16H14O/c1-2-6-13(7-3-1)12-17-16-11-5-9-14-8-4-10-15(14)16/h1-7,9-11H,8,12H2
InChIKeyUJRXYBMBVLQWPB-UHFFFAOYSA-N
MW222.29 g/mol
LogP3.83
Rot. Bonds3

About 4-phenylmethoxy-1H-indene

4-phenylmethoxy-1H-indene (PubChem CID 118181545) has the molecular formula C16H14O and a molecular weight of 222.29 g/mol. Its IUPAC name is 4-phenylmethoxy-1H-indene.

Molecular Properties

Compound Name4-phenylmethoxy-1H-indene
PubChem CID118181545
Molecular FormulaC16H14O
Molecular Weight222.29 g/mol
Exact Mass222.10
IUPAC Name4-phenylmethoxy-1H-indene
SMILESC1=Cc2c(cccc2OCc2ccccc2)C1
InChIInChI=1S/C16H14O/c1-2-6-13(7-3-1)12-17-16-11-5-9-14-8-4-10-15(14)16/h1-7,9-11H,8,12H2
InChIKeyUJRXYBMBVLQWPB-UHFFFAOYSA-N
XLogP3.83
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.29
LogP ≤ 53.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

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(2-hydroxy-3-phenylmethoxyphenyl)methanediol
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CID 102424590
2,3,6,7,10,11-hexakis(phenylmethoxy)triphenylene
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CID 123524365
2-bromo-6-phenylmethoxyphenol
CID 67346586
1-(2-hydroxy-3-phenylmethoxyphenyl)cyclopropane-1-carboxylic acid
CID 117457732
4-phenylmethoxy-1,3-benzodioxole
CID 14180566
2-ethoxy-1-ethyl-3-phenylmethoxybenzene
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2-(2-phenylmethoxyphenyl)azetidine
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Frequently Asked Questions

What is the IUPAC name of 4-phenylmethoxy-1H-indene?
The IUPAC name of 4-phenylmethoxy-1H-indene (CID 118181545) is 4-phenylmethoxy-1H-indene.
What is the SMILES notation for 4-phenylmethoxy-1H-indene?
The canonical SMILES for 4-phenylmethoxy-1H-indene is C1=Cc2c(cccc2OCc2ccccc2)C1.
What is the InChIKey of 4-phenylmethoxy-1H-indene?
The InChIKey is UJRXYBMBVLQWPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14O/c1-2-6-13(7-3-1)12-17-16-11-5-9-14-8-4-10-15(14)16/h1-7,9-11H,8,12H2.
What are the key properties of 4-phenylmethoxy-1H-indene?
4-phenylmethoxy-1H-indene has a molecular weight of 222.29 g/mol, XLogP of 3.83, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-phenylmethoxy-1H-indene is sourced from PubChem (CID 118181545), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).