2-(2-prop-2-enylnaphthalen-1-yl)ethanol

C15H16O — CID 138550919

IUPAC2-(2-prop-2-enylnaphthalen-1-yl)ethanol
SMILESC=CCc1ccc2ccccc2c1CCO
InChIInChI=1S/C15H16O/c1-2-5-12-8-9-13-6-3-4-7-14(13)15(12)10-11-16/h2-4,6-9,16H,1,5,10-11H2
InChIKeyUYZFHDJTORNUTA-UHFFFAOYSA-N
MW212.29 g/mol
LogP3.10
Rot. Bonds4

About 2-(2-prop-2-enylnaphthalen-1-yl)ethanol

2-(2-prop-2-enylnaphthalen-1-yl)ethanol (PubChem CID 138550919) has the molecular formula C15H16O and a molecular weight of 212.29 g/mol. Its IUPAC name is 2-(2-prop-2-enylnaphthalen-1-yl)ethanol.

Molecular Properties

Compound Name2-(2-prop-2-enylnaphthalen-1-yl)ethanol
PubChem CID138550919
Molecular FormulaC15H16O
Molecular Weight212.29 g/mol
Exact Mass212.12
IUPAC Name2-(2-prop-2-enylnaphthalen-1-yl)ethanol
SMILESC=CCc1ccc2ccccc2c1CCO
InChIInChI=1S/C15H16O/c1-2-5-12-8-9-13-6-3-4-7-14(13)15(12)10-11-16/h2-4,6-9,16H,1,5,10-11H2
InChIKeyUYZFHDJTORNUTA-UHFFFAOYSA-N
XLogP3.10
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.29
LogP ≤ 53.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

1-ethyl-2-prop-2-enylnaphthalene
CID 90721698
1-benzyl-2-prop-2-enylnaphthalene
CID 173093978
(4-prop-2-enylnaphthalen-1-yl)methanol
CID 177415182
1-(2-hydroxyethyl)naphthalen-2-ol
CID 19602212
naphthalen-1-ol;2-prop-2-enylphenol
CID 174719033
2-[1-[2-(2-hydroxyethyl)naphthalen-1-yl]naphthalen-2-yl]ethanol
CID 10405122
sodium 2-prop-2-enylnaphthalene-1-carboxylate
CID 67763509
formaldehyde;1-prop-2-enylnaphthalene
CID 69326534
CID 119080224
CID 119080224
carbonic acid;formaldehyde;1-prop-2-enylnaphthalene
CID 175360952
2-[4-(2-hydroxyethyl)naphthalen-1-yl]ethanol
CID 12582392
2-[5-(2-hydroxyethyl)chrysen-6-yl]ethanol
CID 87369423

Frequently Asked Questions

What is the IUPAC name of 2-(2-prop-2-enylnaphthalen-1-yl)ethanol?
The IUPAC name of 2-(2-prop-2-enylnaphthalen-1-yl)ethanol (CID 138550919) is 2-(2-prop-2-enylnaphthalen-1-yl)ethanol.
What is the SMILES notation for 2-(2-prop-2-enylnaphthalen-1-yl)ethanol?
The canonical SMILES for 2-(2-prop-2-enylnaphthalen-1-yl)ethanol is C=CCc1ccc2ccccc2c1CCO.
What is the InChIKey of 2-(2-prop-2-enylnaphthalen-1-yl)ethanol?
The InChIKey is UYZFHDJTORNUTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16O/c1-2-5-12-8-9-13-6-3-4-7-14(13)15(12)10-11-16/h2-4,6-9,16H,1,5,10-11H2.
What are the key properties of 2-(2-prop-2-enylnaphthalen-1-yl)ethanol?
2-(2-prop-2-enylnaphthalen-1-yl)ethanol has a molecular weight of 212.29 g/mol, XLogP of 3.10, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-prop-2-enylnaphthalen-1-yl)ethanol is sourced from PubChem (CID 138550919), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).