2-[8-(2-hydroxyethoxy)naphthalen-1-yl]oxyethanol

C14H16O4 — CID 21424545

IUPAC2-[8-(2-hydroxyethoxy)naphthalen-1-yl]oxyethanol
SMILESOCCOc1cccc2cccc(OCCO)c12
InChIInChI=1S/C14H16O4/c15-7-9-17-12-5-1-3-11-4-2-6-13(14(11)12)18-10-8-16/h1-6,15-16H,7-10H2
InChIKeySVRLEDBOOSEBIJ-UHFFFAOYSA-N
MW248.28 g/mol
LogP1.58
Rot. Bonds6

About 2-[8-(2-hydroxyethoxy)naphthalen-1-yl]oxyethanol

2-[8-(2-hydroxyethoxy)naphthalen-1-yl]oxyethanol (PubChem CID 21424545) has the molecular formula C14H16O4 and a molecular weight of 248.28 g/mol. Its IUPAC name is 2-[8-(2-hydroxyethoxy)naphthalen-1-yl]oxyethanol.

Molecular Properties

Compound Name2-[8-(2-hydroxyethoxy)naphthalen-1-yl]oxyethanol
PubChem CID21424545
Molecular FormulaC14H16O4
Molecular Weight248.28 g/mol
Exact Mass248.10
IUPAC Name2-[8-(2-hydroxyethoxy)naphthalen-1-yl]oxyethanol
SMILESOCCOc1cccc2cccc(OCCO)c12
InChIInChI=1S/C14H16O4/c15-7-9-17-12-5-1-3-11-4-2-6-13(14(11)12)18-10-8-16/h1-6,15-16H,7-10H2
InChIKeySVRLEDBOOSEBIJ-UHFFFAOYSA-N
XLogP1.58
TPSA58.92 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.28
LogP ≤ 51.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2,6-bis(2-hydroxyethoxy)benzoic acid
CID 54256937
2-[2-(2-hydroxyethoxy)-3-methylphenoxy]ethanol
CID 139797700
2-[(2-bromo-3-pyridinyl)oxy]ethanol
CID 22036263
(1S)-1-[2-(2-hydroxyethoxy)phenyl]ethanol
CID 78931625
3,6-bis(2-hydroxyethoxy)benzene-1,2-diol
CID 18513327
2-[2-[(2,6-dichlorophenyl)methoxy]phenoxy]ethanol
CID 78879031
2-(2-pyrimidin-5-ylphenoxy)ethanol
CID 10560658
2-(3-methoxy-2-phenylphenoxy)ethanol
CID 91364527
2-[2-(aminomethyl)phenoxy]ethanol;hydrochloride
CID 67183570
2-[4-(2-hydroxyethoxy)-2,3-dimethylphenoxy]ethanol
CID 14025005
4-[2,3-bis(4-hydroxybutoxy)phenoxy]butan-1-ol
CID 135239341
2-(1H-benzimidazol-4-yloxy)ethanol
CID 70333523

Frequently Asked Questions

What is the IUPAC name of 2-[8-(2-hydroxyethoxy)naphthalen-1-yl]oxyethanol?
The IUPAC name of 2-[8-(2-hydroxyethoxy)naphthalen-1-yl]oxyethanol (CID 21424545) is 2-[8-(2-hydroxyethoxy)naphthalen-1-yl]oxyethanol.
What is the SMILES notation for 2-[8-(2-hydroxyethoxy)naphthalen-1-yl]oxyethanol?
The canonical SMILES for 2-[8-(2-hydroxyethoxy)naphthalen-1-yl]oxyethanol is OCCOc1cccc2cccc(OCCO)c12.
What is the InChIKey of 2-[8-(2-hydroxyethoxy)naphthalen-1-yl]oxyethanol?
The InChIKey is SVRLEDBOOSEBIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16O4/c15-7-9-17-12-5-1-3-11-4-2-6-13(14(11)12)18-10-8-16/h1-6,15-16H,7-10H2.
What are the key properties of 2-[8-(2-hydroxyethoxy)naphthalen-1-yl]oxyethanol?
2-[8-(2-hydroxyethoxy)naphthalen-1-yl]oxyethanol has a molecular weight of 248.28 g/mol, XLogP of 1.58, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[8-(2-hydroxyethoxy)naphthalen-1-yl]oxyethanol is sourced from PubChem (CID 21424545), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).