2,7-bis(4-methoxyphenyl)-9H-fluorene

C27H22O2 — CID 67050058

IUPAC2,7-bis(4-methoxyphenyl)-9H-fluorene
SMILESCOc1ccc(-c2ccc3c(c2)Cc2cc(-c4ccc(OC)cc4)ccc2-3)cc1
InChIInChI=1S/C27H22O2/c1-28-24-9-3-18(4-10-24)20-7-13-26-22(15-20)17-23-16-21(8-14-27(23)26)19-5-11-25(29-2)12-6-19/h3-16H,17H2,1-2H3
InChIKeyILTVZDDCBFTTOB-UHFFFAOYSA-N
MW378.47 g/mol
LogP6.61
Rot. Bonds4

About 2,7-bis(4-methoxyphenyl)-9H-fluorene

2,7-bis(4-methoxyphenyl)-9H-fluorene (PubChem CID 67050058) has the molecular formula C27H22O2 and a molecular weight of 378.47 g/mol. Its IUPAC name is 2,7-bis(4-methoxyphenyl)-9H-fluorene.

Molecular Properties

Compound Name2,7-bis(4-methoxyphenyl)-9H-fluorene
PubChem CID67050058
Molecular FormulaC27H22O2
Molecular Weight378.47 g/mol
Exact Mass378.16
IUPAC Name2,7-bis(4-methoxyphenyl)-9H-fluorene
SMILESCOc1ccc(-c2ccc3c(c2)Cc2cc(-c4ccc(OC)cc4)ccc2-3)cc1
InChIInChI=1S/C27H22O2/c1-28-24-9-3-18(4-10-24)20-7-13-26-22(15-20)17-23-16-21(8-14-27(23)26)19-5-11-25(29-2)12-6-19/h3-16H,17H2,1-2H3
InChIKeyILTVZDDCBFTTOB-UHFFFAOYSA-N
XLogP6.61
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500378.47
LogP ≤ 56.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

5-(4-methoxyphenyl)-2,3-dihydro-1H-indene
CID 174495495
6-(4-methoxyphenyl)-3-methyl-1H-indene
CID 10955553
5-(4-methoxyphenyl)-2,3-dihydroinden-1-one
CID 11149112
2-N,2-N,7-N,7-N-tetrakis(4-methoxyphenyl)-9H-fluorene-2,7-diamine
CID 161479065
3,6-dimethoxy-10H-anthracen-9-one
CID 142018270
1,4-bis(4-methylphenyl)benzene;2,7-dimethyl-9H-fluorene;2,6-dimethylnaphthalene;1-methyl-4-(4-methylphenyl)benzene;1,4-xylene
CID 163621135
2-methoxy-6-(4-methoxyphenyl)naphthalene
CID 11149734
6-(4-methoxyphenyl)-2-methyl-1,2,3,4-tetrahydronaphthalene
CID 20500036
2-(4-methoxyphenyl)-1,4-diphenylbenzene
CID 132547745
1-methoxy-2,4-bis(4-methoxyphenyl)benzene
CID 102598609
5,13-bis(4-methoxyphenyl)-1,9-diazatetracyclo[7.7.1.02,7.010,15]heptadeca-2(7),3,5,10(15),11,13-hexaene
CID 11532152
7-(4-methylphenyl)-9H-fluoren-2-amine
CID 59742324

Frequently Asked Questions

What is the IUPAC name of 2,7-bis(4-methoxyphenyl)-9H-fluorene?
The IUPAC name of 2,7-bis(4-methoxyphenyl)-9H-fluorene (CID 67050058) is 2,7-bis(4-methoxyphenyl)-9H-fluorene.
What is the SMILES notation for 2,7-bis(4-methoxyphenyl)-9H-fluorene?
The canonical SMILES for 2,7-bis(4-methoxyphenyl)-9H-fluorene is COc1ccc(-c2ccc3c(c2)Cc2cc(-c4ccc(OC)cc4)ccc2-3)cc1.
What is the InChIKey of 2,7-bis(4-methoxyphenyl)-9H-fluorene?
The InChIKey is ILTVZDDCBFTTOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H22O2/c1-28-24-9-3-18(4-10-24)20-7-13-26-22(15-20)17-23-16-21(8-14-27(23)26)19-5-11-25(29-2)12-6-19/h3-16H,17H2,1-2H3.
What are the key properties of 2,7-bis(4-methoxyphenyl)-9H-fluorene?
2,7-bis(4-methoxyphenyl)-9H-fluorene has a molecular weight of 378.47 g/mol, XLogP of 6.61, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,7-bis(4-methoxyphenyl)-9H-fluorene is sourced from PubChem (CID 67050058), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).