6,7-dimethoxy-3-methyl-1,2-dihydronaphthalene

C13H16O2 — CID 10703379

IUPAC6,7-dimethoxy-3-methyl-1,2-dihydronaphthalene
SMILESCOc1cc2c(cc1OC)CCC(C)=C2
InChIInChI=1S/C13H16O2/c1-9-4-5-10-7-12(14-2)13(15-3)8-11(10)6-9/h6-8H,4-5H2,1-3H3
InChIKeyAZPWKHKZDLLCBR-UHFFFAOYSA-N
MW204.27 g/mol
LogP3.05
Rot. Bonds2

About 6,7-dimethoxy-3-methyl-1,2-dihydronaphthalene

6,7-dimethoxy-3-methyl-1,2-dihydronaphthalene (PubChem CID 10703379) has the molecular formula C13H16O2 and a molecular weight of 204.27 g/mol. Its IUPAC name is 6,7-dimethoxy-3-methyl-1,2-dihydronaphthalene.

Molecular Properties

Compound Name6,7-dimethoxy-3-methyl-1,2-dihydronaphthalene
PubChem CID10703379
Molecular FormulaC13H16O2
Molecular Weight204.27 g/mol
Exact Mass204.12
IUPAC Name6,7-dimethoxy-3-methyl-1,2-dihydronaphthalene
SMILESCOc1cc2c(cc1OC)CCC(C)=C2
InChIInChI=1S/C13H16O2/c1-9-4-5-10-7-12(14-2)13(15-3)8-11(10)6-9/h6-8H,4-5H2,1-3H3
InChIKeyAZPWKHKZDLLCBR-UHFFFAOYSA-N
XLogP3.05
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.27
LogP ≤ 53.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2,3,6,7-tetramethoxy-9,10-dihydrophenanthrene
CID 848565
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CID 129117919
1-[(6,7-dimethoxy-3,4-dihydronaphthalen-2-yl)methyl]pyrrolidine;hydrochloride
CID 90673394
(5E)-2,3-dimethoxy-7,8,9,10-tetrahydrobenzo[8]annulene-6-carboxylic acid
CID 10106763
5,6,13,14-tetramethoxytricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,9,11,13-heptaene
CID 628542
6,7,14,15-tetramethoxytetracyclo[18.4.0.04,9.012,17]tetracosa-1(24),4,6,8,12,14,16,20,22-nonaene
CID 172869288
5,12-dimethoxytricyclo[8.2.2.24,7]hexadeca-1(12),4,6,10,13,15-hexaene
CID 15073818
3,6-dimethyl-1,2-dihydronaphthalene;propane
CID 144809006
3,4-dimethoxybicyclo[4.2.0]octa-1,3,5-triene;N-methylethanamine
CID 143683938
bis(3-bromo-6,7-dimethoxy-1H-naphthalen-2-one);methane
CID 157147537
3-(6,7-dimethoxy-3,4-dihydronaphthalen-2-yl)-1-piperidin-1-ylprop-2-en-1-one
CID 75243230
1-[2-(6,7-dimethoxy-3,4-dihydronaphthalen-2-yl)ethyl]-3-fluoropyrrolidine
CID 22104543

Frequently Asked Questions

What is the IUPAC name of 6,7-dimethoxy-3-methyl-1,2-dihydronaphthalene?
The IUPAC name of 6,7-dimethoxy-3-methyl-1,2-dihydronaphthalene (CID 10703379) is 6,7-dimethoxy-3-methyl-1,2-dihydronaphthalene.
What is the SMILES notation for 6,7-dimethoxy-3-methyl-1,2-dihydronaphthalene?
The canonical SMILES for 6,7-dimethoxy-3-methyl-1,2-dihydronaphthalene is COc1cc2c(cc1OC)CCC(C)=C2.
What is the InChIKey of 6,7-dimethoxy-3-methyl-1,2-dihydronaphthalene?
The InChIKey is AZPWKHKZDLLCBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16O2/c1-9-4-5-10-7-12(14-2)13(15-3)8-11(10)6-9/h6-8H,4-5H2,1-3H3.
What are the key properties of 6,7-dimethoxy-3-methyl-1,2-dihydronaphthalene?
6,7-dimethoxy-3-methyl-1,2-dihydronaphthalene has a molecular weight of 204.27 g/mol, XLogP of 3.05, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6,7-dimethoxy-3-methyl-1,2-dihydronaphthalene is sourced from PubChem (CID 10703379), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).