7,8-dimethoxy-1,2-dihydronaphthalen-2-ol

C12H14O3 — CID 174744187

IUPAC7,8-dimethoxy-1,2-dihydronaphthalen-2-ol
SMILESCOc1ccc2c(c1OC)CC(O)C=C2
InChIInChI=1S/C12H14O3/c1-14-11-6-4-8-3-5-9(13)7-10(8)12(11)15-2/h3-6,9,13H,7H2,1-2H3
InChIKeyTUQZWHFDNHZVCM-UHFFFAOYSA-N
MW206.24 g/mol
LogP1.63
Rot. Bonds2

About 7,8-dimethoxy-1,2-dihydronaphthalen-2-ol

7,8-dimethoxy-1,2-dihydronaphthalen-2-ol (PubChem CID 174744187) has the molecular formula C12H14O3 and a molecular weight of 206.24 g/mol. Its IUPAC name is 7,8-dimethoxy-1,2-dihydronaphthalen-2-ol.

Molecular Properties

Compound Name7,8-dimethoxy-1,2-dihydronaphthalen-2-ol
PubChem CID174744187
Molecular FormulaC12H14O3
Molecular Weight206.24 g/mol
Exact Mass206.09
IUPAC Name7,8-dimethoxy-1,2-dihydronaphthalen-2-ol
SMILESCOc1ccc2c(c1OC)CC(O)C=C2
InChIInChI=1S/C12H14O3/c1-14-11-6-4-8-3-5-9(13)7-10(8)12(11)15-2/h3-6,9,13H,7H2,1-2H3
InChIKeyTUQZWHFDNHZVCM-UHFFFAOYSA-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

(2S)-5,8-dimethoxy-1,2-dihydronaphthalen-2-ol
CID 101157510
1,2-dimethoxy-5,6,7,8,9,10,11,12-octahydrobenzo[10]annulen-5-ol
CID 23730575
1-(tert-butylamino)-5,6-dimethoxy-1,2,3,4-tetrahydronaphthalen-2-ol;hydrochloride
CID 163779890
methyl 5,6-dimethoxy-2-oxo-3,4-dihydro-1H-naphthalene-1-carboxylate
CID 11311593
methyl (1R)-5,6-dimethoxy-2-oxo-3,4-dihydro-1H-naphthalene-1-carboxylate
CID 124559713
(1R,10S,12S,16S)-3,4,17,17-tetramethoxy-13-methyl-13-azatetracyclo[10.3.2.01,10.02,7]heptadeca-2(7),3,5,8-tetraen-16-ol
CID 139050629
(3S)-7,8-dimethoxy-3-methyl-1,2,3,4-tetrahydroisoquinoline
CID 95366245
5,6-dimethoxy-1,2,3,4-tetrahydronaphthalene-1-carboxylic acid
CID 10561783
(3S)-5,6-dimethoxy-3-phenyl-3,4-dihydro-2H-naphthalen-1-one
CID 129365943
(13E)-3,4-dimethoxy-6-methyl-7,8-dihydro-5H-benzo[e][2]benzazecine
CID 102295748
1-cyclopropyl-2,3-dimethoxybenzene
CID 22923325
6,7-dimethoxy-1-methyl-2,3,4,5-tetrahydro-1H-2-benzazepine
CID 83691109

Frequently Asked Questions

What is the IUPAC name of 7,8-dimethoxy-1,2-dihydronaphthalen-2-ol?
The IUPAC name of 7,8-dimethoxy-1,2-dihydronaphthalen-2-ol (CID 174744187) is 7,8-dimethoxy-1,2-dihydronaphthalen-2-ol.
What is the SMILES notation for 7,8-dimethoxy-1,2-dihydronaphthalen-2-ol?
The canonical SMILES for 7,8-dimethoxy-1,2-dihydronaphthalen-2-ol is COc1ccc2c(c1OC)CC(O)C=C2.
What is the InChIKey of 7,8-dimethoxy-1,2-dihydronaphthalen-2-ol?
The InChIKey is TUQZWHFDNHZVCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14O3/c1-14-11-6-4-8-3-5-9(13)7-10(8)12(11)15-2/h3-6,9,13H,7H2,1-2H3.
What are the key properties of 7,8-dimethoxy-1,2-dihydronaphthalen-2-ol?
7,8-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 7,8-dimethoxy-1,2-dihydronaphthalen-2-ol is sourced from PubChem (CID 174744187), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).