2,3-dimethoxy-1-methyl-9H-fluorene

C16H16O2 — CID 156613196

IUPAC2,3-dimethoxy-1-methyl-9H-fluorene
SMILESCOc1cc2c(c(C)c1OC)Cc1ccccc1-2
InChIInChI=1S/C16H16O2/c1-10-13-8-11-6-4-5-7-12(11)14(13)9-15(17-2)16(10)18-3/h4-7,9H,8H2,1-3H3
InChIKeyBGIGZYMLBDNLSB-UHFFFAOYSA-N
MW240.30 g/mol
LogP3.58
Rot. Bonds2

About 2,3-dimethoxy-1-methyl-9H-fluorene

2,3-dimethoxy-1-methyl-9H-fluorene (PubChem CID 156613196) has the molecular formula C16H16O2 and a molecular weight of 240.30 g/mol. Its IUPAC name is 2,3-dimethoxy-1-methyl-9H-fluorene.

Molecular Properties

Compound Name2,3-dimethoxy-1-methyl-9H-fluorene
PubChem CID156613196
Molecular FormulaC16H16O2
Molecular Weight240.30 g/mol
Exact Mass240.12
IUPAC Name2,3-dimethoxy-1-methyl-9H-fluorene
SMILESCOc1cc2c(c(C)c1OC)Cc1ccccc1-2
InChIInChI=1S/C16H16O2/c1-10-13-8-11-6-4-5-7-12(11)14(13)9-15(17-2)16(10)18-3/h4-7,9H,8H2,1-3H3
InChIKeyBGIGZYMLBDNLSB-UHFFFAOYSA-N
XLogP3.58
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 ≤ 53.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,3-dimethoxy-1-methyl-9H-fluorene?
The IUPAC name of 2,3-dimethoxy-1-methyl-9H-fluorene (CID 156613196) is 2,3-dimethoxy-1-methyl-9H-fluorene.
What is the SMILES notation for 2,3-dimethoxy-1-methyl-9H-fluorene?
The canonical SMILES for 2,3-dimethoxy-1-methyl-9H-fluorene is COc1cc2c(c(C)c1OC)Cc1ccccc1-2.
What is the InChIKey of 2,3-dimethoxy-1-methyl-9H-fluorene?
The InChIKey is BGIGZYMLBDNLSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16O2/c1-10-13-8-11-6-4-5-7-12(11)14(13)9-15(17-2)16(10)18-3/h4-7,9H,8H2,1-3H3.
What are the key properties of 2,3-dimethoxy-1-methyl-9H-fluorene?
2,3-dimethoxy-1-methyl-9H-fluorene has a molecular weight of 240.30 g/mol, XLogP of 3.58, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dimethoxy-1-methyl-9H-fluorene is sourced from PubChem (CID 156613196), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).