1-[6-(methoxymethyl)naphthalen-2-yl]ethanol

C14H16O2 — CID 542652

IUPAC1-[6-(methoxymethyl)naphthalen-2-yl]ethanol
SMILESCOCc1ccc2cc(C(C)O)ccc2c1
InChIInChI=1S/C14H16O2/c1-10(15)12-5-6-13-7-11(9-16-2)3-4-14(13)8-12/h3-8,10,15H,9H2,1-2H3
InChIKeyUVZTVMSMNYIWAK-UHFFFAOYSA-N
MW216.28 g/mol
LogP3.04
Rot. Bonds3

About 1-[6-(methoxymethyl)naphthalen-2-yl]ethanol

1-[6-(methoxymethyl)naphthalen-2-yl]ethanol (PubChem CID 542652) has the molecular formula C14H16O2 and a molecular weight of 216.28 g/mol. Its IUPAC name is 1-[6-(methoxymethyl)naphthalen-2-yl]ethanol.

Molecular Properties

Compound Name1-[6-(methoxymethyl)naphthalen-2-yl]ethanol
PubChem CID542652
Molecular FormulaC14H16O2
Molecular Weight216.28 g/mol
Exact Mass216.12
IUPAC Name1-[6-(methoxymethyl)naphthalen-2-yl]ethanol
SMILESCOCc1ccc2cc(C(C)O)ccc2c1
InChIInChI=1S/C14H16O2/c1-10(15)12-5-6-13-7-11(9-16-2)3-4-14(13)8-12/h3-8,10,15H,9H2,1-2H3
InChIKeyUVZTVMSMNYIWAK-UHFFFAOYSA-N
XLogP3.04
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.28
LogP ≤ 53.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[1,1'-Biphenyl]-3-methanol, 2-methyl-
CID 596875
1-Naphthalenemethanol
CID 20908
9-Anthracenemethanol
CID 73848
1-Pyrenemethanol
CID 104977
2-Naphthalenemethanol
CID 74128
Benzo(a)pyrene-7,8-dihydrodiol
CID 25892
12-Methylbenz(a)anthracene-7-methanol
CID 11285
Bay 27-9955
CID 5311277
7-Hydroxy-7,8,9,10-tetrahydrobenzo(a)pyrene
CID 97714
1-(1-Pyrenyl)ethanol
CID 119118
2-Pyrenemethanol
CID 146932
3-(5'-{2-[3,4-Bis(Hydroxymethyl)phenyl]ethyl}-2'-Methyl-2-Propylbiphenyl-4-Yl)pentan-3-Ol
CID 9847095

Frequently Asked Questions

What is the IUPAC name of 1-[6-(methoxymethyl)naphthalen-2-yl]ethanol?
The IUPAC name of 1-[6-(methoxymethyl)naphthalen-2-yl]ethanol (CID 542652) is 1-[6-(methoxymethyl)naphthalen-2-yl]ethanol.
What is the SMILES notation for 1-[6-(methoxymethyl)naphthalen-2-yl]ethanol?
The canonical SMILES for 1-[6-(methoxymethyl)naphthalen-2-yl]ethanol is COCc1ccc2cc(C(C)O)ccc2c1.
What is the InChIKey of 1-[6-(methoxymethyl)naphthalen-2-yl]ethanol?
The InChIKey is UVZTVMSMNYIWAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16O2/c1-10(15)12-5-6-13-7-11(9-16-2)3-4-14(13)8-12/h3-8,10,15H,9H2,1-2H3.
What are the key properties of 1-[6-(methoxymethyl)naphthalen-2-yl]ethanol?
1-[6-(methoxymethyl)naphthalen-2-yl]ethanol has a molecular weight of 216.28 g/mol, XLogP of 3.04, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[6-(methoxymethyl)naphthalen-2-yl]ethanol is sourced from PubChem (CID 542652), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).