1-(2,3-dimethoxyphenyl)-9H-fluorene

C21H18O2 — CID 150272251

IUPAC1-(2,3-dimethoxyphenyl)-9H-fluorene
SMILESCOc1cccc(-c2cccc3c2Cc2ccccc2-3)c1OC
InChIInChI=1S/C21H18O2/c1-22-20-12-6-11-18(21(20)23-2)17-10-5-9-16-15-8-4-3-7-14(15)13-19(16)17/h3-12H,13H2,1-2H3
InChIKeyGDUSEZUTXXVELX-UHFFFAOYSA-N
MW302.37 g/mol
LogP4.94
Rot. Bonds3

About 1-(2,3-dimethoxyphenyl)-9H-fluorene

1-(2,3-dimethoxyphenyl)-9H-fluorene (PubChem CID 150272251) has the molecular formula C21H18O2 and a molecular weight of 302.37 g/mol. Its IUPAC name is 1-(2,3-dimethoxyphenyl)-9H-fluorene.

Molecular Properties

Compound Name1-(2,3-dimethoxyphenyl)-9H-fluorene
PubChem CID150272251
Molecular FormulaC21H18O2
Molecular Weight302.37 g/mol
Exact Mass302.13
IUPAC Name1-(2,3-dimethoxyphenyl)-9H-fluorene
SMILESCOc1cccc(-c2cccc3c2Cc2ccccc2-3)c1OC
InChIInChI=1S/C21H18O2/c1-22-20-12-6-11-18(21(20)23-2)17-10-5-9-16-15-8-4-3-7-14(15)13-19(16)17/h3-12H,13H2,1-2H3
InChIKeyGDUSEZUTXXVELX-UHFFFAOYSA-N
XLogP4.94
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.37
LogP ≤ 54.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-(9H-fluoren-1-yl)-9H-fluorene
CID 19077838
2,3-dimethoxy-1-methyl-9H-fluorene
CID 156613196
3-(2,3-dimethoxyphenyl)-4H-isoquinolin-1-one
CID 69183555
1-(3,5-dimethoxyphenyl)-9H-fluorene
CID 152594732
1-[2,3,4,5,6-pentakis(9H-fluoren-1-yl)phenyl]-9H-fluorene
CID 141308542
[2-(9H-fluoren-1-yl)phenoxy]boronic acid
CID 69456186
12-methoxytricyclo[9.4.0.03,8]pentadeca-1(11),3,5,7,12,14-hexaen-9-one
CID 141002477
2-methoxy-1-nitro-9H-fluorene
CID 159208657
acetic acid;1-(9H-fluoren-1-yloxy)-9H-fluorene
CID 162313144
(2E)-2-[(2,3-dimethoxyphenyl)methylidene]-3H-inden-1-one
CID 2342691
[2-(9H-fluoren-1-yl)phenoxy]-diphenylphosphane
CID 141312348
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

Frequently Asked Questions

What is the IUPAC name of 1-(2,3-dimethoxyphenyl)-9H-fluorene?
The IUPAC name of 1-(2,3-dimethoxyphenyl)-9H-fluorene (CID 150272251) is 1-(2,3-dimethoxyphenyl)-9H-fluorene.
What is the SMILES notation for 1-(2,3-dimethoxyphenyl)-9H-fluorene?
The canonical SMILES for 1-(2,3-dimethoxyphenyl)-9H-fluorene is COc1cccc(-c2cccc3c2Cc2ccccc2-3)c1OC.
What is the InChIKey of 1-(2,3-dimethoxyphenyl)-9H-fluorene?
The InChIKey is GDUSEZUTXXVELX-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H18O2/c1-22-20-12-6-11-18(21(20)23-2)17-10-5-9-16-15-8-4-3-7-14(15)13-19(16)17/h3-12H,13H2,1-2H3.
What are the key properties of 1-(2,3-dimethoxyphenyl)-9H-fluorene?
1-(2,3-dimethoxyphenyl)-9H-fluorene has a molecular weight of 302.37 g/mol, XLogP of 4.94, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,3-dimethoxyphenyl)-9H-fluorene is sourced from PubChem (CID 150272251), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).