9,10-bis(methoxymethoxy)anthracene

C18H18O4 — CID 150706504

IUPAC9,10-bis(methoxymethoxy)anthracene
SMILESCOCOc1c2ccccc2c(OCOC)c2ccccc12
InChIInChI=1S/C18H18O4/c1-19-11-21-17-13-7-3-5-9-15(13)18(22-12-20-2)16-10-6-4-8-14(16)17/h3-10H,11-12H2,1-2H3
InChIKeyJMZCWCQJGJBXPE-UHFFFAOYSA-N
MW298.34 g/mol
LogP3.96
Rot. Bonds6

About 9,10-bis(methoxymethoxy)anthracene

9,10-bis(methoxymethoxy)anthracene (PubChem CID 150706504) has the molecular formula C18H18O4 and a molecular weight of 298.34 g/mol. Its IUPAC name is 9,10-bis(methoxymethoxy)anthracene.

Molecular Properties

Compound Name9,10-bis(methoxymethoxy)anthracene
PubChem CID150706504
Molecular FormulaC18H18O4
Molecular Weight298.34 g/mol
Exact Mass298.12
IUPAC Name9,10-bis(methoxymethoxy)anthracene
SMILESCOCOc1c2ccccc2c(OCOC)c2ccccc12
InChIInChI=1S/C18H18O4/c1-19-11-21-17-13-7-3-5-9-15(13)18(22-12-20-2)16-10-6-4-8-14(16)17/h3-10H,11-12H2,1-2H3
InChIKeyJMZCWCQJGJBXPE-UHFFFAOYSA-N
XLogP3.96
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.34
LogP ≤ 53.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}

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Related Compounds

3-bromo-1-[3-bromo-2-(methoxymethoxy)naphthalen-1-yl]-2-(methoxymethoxy)naphthalene;sulfane
CID 155819548
3-bromo-2-(methoxymethoxy)-1-methylnaphthalene
CID 135380428
3-(methoxymethoxy)-4-methylchromen-2-one
CID 90835819
1-bromo-3-methoxy-2-(methoxymethoxy)naphthalene
CID 135381311
[4-fluoro-1-(methoxymethoxy)naphthalen-2-yl] acetate
CID 174532407
3-[3-amino-2-(methoxymethoxy)phenyl]-2-(methoxymethoxy)aniline
CID 135022405
1-iodo-3-[3-iodo-2-(methoxymethoxy)phenyl]-2-(methoxymethoxy)benzene
CID 139094627
[2-(methoxymethoxy)phenyl]methanol
CID 10920904
1,4-bis(methoxymethoxy)benzene
CID 542643
1,3,5-triiodo-2-(methoxymethoxy)benzene
CID 102384226
1,2-bis(methoxymethoxy)-3-phenylbenzene
CID 11000249
[4-(methoxymethoxy)-3,5-dimethylphenyl]-diphenylsulfanium
CID 164717649

Frequently Asked Questions

What is the IUPAC name of 9,10-bis(methoxymethoxy)anthracene?
The IUPAC name of 9,10-bis(methoxymethoxy)anthracene (CID 150706504) is 9,10-bis(methoxymethoxy)anthracene.
What is the SMILES notation for 9,10-bis(methoxymethoxy)anthracene?
The canonical SMILES for 9,10-bis(methoxymethoxy)anthracene is COCOc1c2ccccc2c(OCOC)c2ccccc12.
What is the InChIKey of 9,10-bis(methoxymethoxy)anthracene?
The InChIKey is JMZCWCQJGJBXPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18O4/c1-19-11-21-17-13-7-3-5-9-15(13)18(22-12-20-2)16-10-6-4-8-14(16)17/h3-10H,11-12H2,1-2H3.
What are the key properties of 9,10-bis(methoxymethoxy)anthracene?
9,10-bis(methoxymethoxy)anthracene has a molecular weight of 298.34 g/mol, XLogP of 3.96, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 9,10-bis(methoxymethoxy)anthracene is sourced from PubChem (CID 150706504), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).