1,8-dimethoxy-9,10-dihydroanthracene

C16H16O2 — CID 12651974

IUPAC1,8-dimethoxy-9,10-dihydroanthracene
SMILESCOc1cccc2c1Cc1c(cccc1OC)C2
InChIInChI=1S/C16H16O2/c1-17-15-7-3-5-11-9-12-6-4-8-16(18-2)14(12)10-13(11)15/h3-8H,9-10H2,1-2H3
InChIKeyOCAFEWLZRWMLMT-UHFFFAOYSA-N
MW240.30 g/mol
LogP3.20
Rot. Bonds2

About 1,8-dimethoxy-9,10-dihydroanthracene

1,8-dimethoxy-9,10-dihydroanthracene (PubChem CID 12651974) has the molecular formula C16H16O2 and a molecular weight of 240.30 g/mol. Its IUPAC name is 1,8-dimethoxy-9,10-dihydroanthracene.

Molecular Properties

Compound Name1,8-dimethoxy-9,10-dihydroanthracene
PubChem CID12651974
Molecular FormulaC16H16O2
Molecular Weight240.30 g/mol
Exact Mass240.12
IUPAC Name1,8-dimethoxy-9,10-dihydroanthracene
SMILESCOc1cccc2c1Cc1c(cccc1OC)C2
InChIInChI=1S/C16H16O2/c1-17-15-7-3-5-11-9-12-6-4-8-16(18-2)14(12)10-13(11)15/h3-8H,9-10H2,1-2H3
InChIKeyOCAFEWLZRWMLMT-UHFFFAOYSA-N
XLogP3.20
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.30
LogP ≤ 53.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

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8-methoxy-3,4-dihydro-1H-naphthalen-2-one
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4,13,22-trimethoxyheptacyclo[18.7.0.02,10.03,8.011,19.012,17.021,26]heptacosa-1,3(8),4,6,10,12(17),13,15,19,21(26),22,24-dodecaene
CID 10694042
4-methoxy-5,6,7,8,9,10-hexahydrobenzo[8]annulene
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methyl 8-methoxy-1,4-dihydronaphthalene-2-carboxylate
CID 10751295
5-methoxy-1,2,3,4-tetrahydronaphthalene-2,3-diol
CID 123352888
(1,6-dimethoxy-5,10-dihydrobenzo[g]isoquinolin-3-yl)-trimethylsilane
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4-bromo-5-methoxy-9H-fluorene
CID 151444335
5-methoxy-3,3-dimethyl-2,4-dihydro-1H-naphthalene
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4-methoxy-1,3-dihydroisoindol-2-amine
CID 125426011
(2S)-8-methoxy-2-methyl-1,2,3,4-tetrahydronaphthalene
CID 67639312

Frequently Asked Questions

What is the IUPAC name of 1,8-dimethoxy-9,10-dihydroanthracene?
The IUPAC name of 1,8-dimethoxy-9,10-dihydroanthracene (CID 12651974) is 1,8-dimethoxy-9,10-dihydroanthracene.
What is the SMILES notation for 1,8-dimethoxy-9,10-dihydroanthracene?
The canonical SMILES for 1,8-dimethoxy-9,10-dihydroanthracene is COc1cccc2c1Cc1c(cccc1OC)C2.
What is the InChIKey of 1,8-dimethoxy-9,10-dihydroanthracene?
The InChIKey is OCAFEWLZRWMLMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16O2/c1-17-15-7-3-5-11-9-12-6-4-8-16(18-2)14(12)10-13(11)15/h3-8H,9-10H2,1-2H3.
What are the key properties of 1,8-dimethoxy-9,10-dihydroanthracene?
1,8-dimethoxy-9,10-dihydroanthracene has a molecular weight of 240.30 g/mol, XLogP of 3.20, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,8-dimethoxy-9,10-dihydroanthracene is sourced from PubChem (CID 12651974), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).