(2S)-5,8-dimethoxy-1,2-dihydronaphthalen-2-ol

C12H14O3 — CID 101157510

IUPAC(2S)-5,8-dimethoxy-1,2-dihydronaphthalen-2-ol
SMILESCOc1ccc(OC)c2c1C=C[C@@H](O)C2
InChIInChI=1S/C12H14O3/c1-14-11-5-6-12(15-2)10-7-8(13)3-4-9(10)11/h3-6,8,13H,7H2,1-2H3/t8-/m1/s1
InChIKeyNVILRSXMLUJMCQ-MRVPVSSYSA-N
MW206.24 g/mol
LogP1.63
Rot. Bonds2

About (2S)-5,8-dimethoxy-1,2-dihydronaphthalen-2-ol

(2S)-5,8-dimethoxy-1,2-dihydronaphthalen-2-ol (PubChem CID 101157510) has the molecular formula C12H14O3 and a molecular weight of 206.24 g/mol. Its IUPAC name is (2S)-5,8-dimethoxy-1,2-dihydronaphthalen-2-ol.

Molecular Properties

Compound Name(2S)-5,8-dimethoxy-1,2-dihydronaphthalen-2-ol
PubChem CID101157510
Molecular FormulaC12H14O3
Molecular Weight206.24 g/mol
Exact Mass206.09
IUPAC Name(2S)-5,8-dimethoxy-1,2-dihydronaphthalen-2-ol
SMILESCOc1ccc(OC)c2c1C=C[C@@H](O)C2
InChIInChI=1S/C12H14O3/c1-14-11-5-6-12(15-2)10-7-8(13)3-4-9(10)11/h3-6,8,13H,7H2,1-2H3/t8-/m1/s1
InChIKeyNVILRSXMLUJMCQ-MRVPVSSYSA-N
XLogP1.63
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.24
LogP ≤ 51.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

7,8-dimethoxy-1,2-dihydronaphthalen-2-ol
CID 174744187
4-methoxy-2-methyl-2,3-dihydro-1H-inden-1-ol
CID 79726670
5,8-dimethoxy-1,2,3,4-tetrahydronaphthalen-2-ol
CID 5073341
1-(4,7-dimethoxy-2,3-dihydro-1H-inden-2-yl)ethanone
CID 86124271
5-methoxy-1,2,3,4-tetrahydronaphthalene-2,3-diol
CID 123352888
2,8-dimethoxytricyclo[7.4.1.05,14]tetradeca-1,3,5(14),6,8,11-hexaene
CID 135038714
5-methoxy-3-methyl-1,2,3,4-tetrahydronaphthalen-1-ol
CID 63822286
(1S,2S)-4,6-dimethoxy-2-(4-methoxyphenyl)-2,3-dihydro-1H-inden-1-ol
CID 71027995
bis(2-(3-hydroxy-5,8-dimethoxy-1,2,3,4-tetrahydronaphthalen-2-yl)guanidine);sulfuric acid
CID 24838578
3-(2-hydroxyethylamino)-5,8-dimethoxy-1,2,3,4-tetrahydronaphthalen-2-ol
CID 3029499
8-methoxy-3-methyl-3,4-dihydro-1H-isothiochromen-4-ol
CID 82886324
(1S,2S)-6,7-dimethoxy-2-phenyl-1,2-dihydronaphthalen-1-ol
CID 132579460

Frequently Asked Questions

What is the IUPAC name of (2S)-5,8-dimethoxy-1,2-dihydronaphthalen-2-ol?
The IUPAC name of (2S)-5,8-dimethoxy-1,2-dihydronaphthalen-2-ol (CID 101157510) is (2S)-5,8-dimethoxy-1,2-dihydronaphthalen-2-ol.
What is the SMILES notation for (2S)-5,8-dimethoxy-1,2-dihydronaphthalen-2-ol?
The canonical SMILES for (2S)-5,8-dimethoxy-1,2-dihydronaphthalen-2-ol is COc1ccc(OC)c2c1C=C[C@@H](O)C2.
What is the InChIKey of (2S)-5,8-dimethoxy-1,2-dihydronaphthalen-2-ol?
The InChIKey is NVILRSXMLUJMCQ-MRVPVSSYSA-N. The full InChI is InChI=1S/C12H14O3/c1-14-11-5-6-12(15-2)10-7-8(13)3-4-9(10)11/h3-6,8,13H,7H2,1-2H3/t8-/m1/s1.
What are the key properties of (2S)-5,8-dimethoxy-1,2-dihydronaphthalen-2-ol?
(2S)-5,8-dimethoxy-1,2-dihydronaphthalen-2-ol has a molecular weight of 206.24 g/mol, XLogP of 1.63, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-5,8-dimethoxy-1,2-dihydronaphthalen-2-ol is sourced from PubChem (CID 101157510), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).