2-(1-methoxy-4,4a-dihydronaphthalen-2-yl)-9,9-dimethylfluorene

C26H24O — CID 91099831

IUPAC2-(1-methoxy-4,4a-dihydronaphthalen-2-yl)-9,9-dimethylfluorene
SMILESCOC1=C2C=CC=CC2CC=C1c1ccc2c(c1)C(C)(C)c1ccccc1-2
InChIInChI=1S/C26H24O/c1-26(2)23-11-7-6-10-21(23)22-15-13-18(16-24(22)26)20-14-12-17-8-4-5-9-19(17)25(20)27-3/h4-11,13-17H,12H2,1-3H3
InChIKeyAYGLFYWFJDBWOX-UHFFFAOYSA-N
MW352.48 g/mol
LogP6.42
Rot. Bonds2

About 2-(1-methoxy-4,4a-dihydronaphthalen-2-yl)-9,9-dimethylfluorene

2-(1-methoxy-4,4a-dihydronaphthalen-2-yl)-9,9-dimethylfluorene (PubChem CID 91099831) has the molecular formula C26H24O and a molecular weight of 352.48 g/mol. Its IUPAC name is 2-(1-methoxy-4,4a-dihydronaphthalen-2-yl)-9,9-dimethylfluorene.

Molecular Properties

Compound Name2-(1-methoxy-4,4a-dihydronaphthalen-2-yl)-9,9-dimethylfluorene
PubChem CID91099831
Molecular FormulaC26H24O
Molecular Weight352.48 g/mol
Exact Mass352.18
IUPAC Name2-(1-methoxy-4,4a-dihydronaphthalen-2-yl)-9,9-dimethylfluorene
SMILESCOC1=C2C=CC=CC2CC=C1c1ccc2c(c1)C(C)(C)c1ccccc1-2
InChIInChI=1S/C26H24O/c1-26(2)23-11-7-6-10-21(23)22-15-13-18(16-24(22)26)20-14-12-17-8-4-5-9-19(17)25(20)27-3/h4-11,13-17H,12H2,1-3H3
InChIKeyAYGLFYWFJDBWOX-UHFFFAOYSA-N
XLogP6.42
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500352.48
LogP ≤ 56.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2-(9,9-dimethylfluoren-2-yl)-7-[6-(6-methoxynaphthalen-2-yl)naphthalen-2-yl]-9,9-dimethylfluorene
CID 90394242
2-[3,5-bis[7-[7-[7-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]phenyl]-7-[7-[7-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluorene
CID 101336380
2,7-bis[3,5-bis[3,5-bis(9,9-dimethylfluoren-2-yl)phenyl]phenyl]-9,9-dimethylfluorene
CID 58881238
N-[4-(9,9-dimethylfluoren-2-yl)cyclohexa-1,5-dien-1-yl]-N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-4-(4-phenylphenyl)aniline
CID 164821085
2-[4-(9,9-dimethylfluoren-2-yl)naphthalen-1-yl]-9,9-dimethylfluorene
CID 59133432
2-(9,9-dimethyl-2,3-dihydrofluoren-2-yl)-9,10-bis(9,9-dimethylfluoren-2-yl)anthracene
CID 91336335
2-[6-(9,9-dimethylfluoren-2-yl)naphthalen-2-yl]-9,9-dimethylfluorene
CID 59133445
2-[6-[6-(9,9-dimethylfluoren-2-yl)naphthalen-2-yl]naphthalen-2-yl]-9,9-dimethylfluorene
CID 58351434
2-(2-methoxy-3-propan-2-ylphenyl)-9,9-dimethylfluorene
CID 70894853
2-(9,9-dimethylfluoren-2-yl)-6-[7-[7-[6-(9,9-dimethylfluoren-2-yl)-2-pyridinyl]-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]pyridine
CID 58881225
2-(9,9-dimethylfluoren-2-yl)-7-[7-[7-[7-[9,9-dimethyl-7-(4-naphthalen-2-ylphenyl)fluoren-2-yl]-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluorene
CID 123392580
2-(9,9-dimethylfluoren-2-yl)-7-[9,9-dimethyl-7-[4-(4-naphthalen-2-ylphenyl)phenyl]fluoren-2-yl]-9,9-dimethylfluorene
CID 123709509

Frequently Asked Questions

What is the IUPAC name of 2-(1-methoxy-4,4a-dihydronaphthalen-2-yl)-9,9-dimethylfluorene?
The IUPAC name of 2-(1-methoxy-4,4a-dihydronaphthalen-2-yl)-9,9-dimethylfluorene (CID 91099831) is 2-(1-methoxy-4,4a-dihydronaphthalen-2-yl)-9,9-dimethylfluorene.
What is the SMILES notation for 2-(1-methoxy-4,4a-dihydronaphthalen-2-yl)-9,9-dimethylfluorene?
The canonical SMILES for 2-(1-methoxy-4,4a-dihydronaphthalen-2-yl)-9,9-dimethylfluorene is COC1=C2C=CC=CC2CC=C1c1ccc2c(c1)C(C)(C)c1ccccc1-2.
What is the InChIKey of 2-(1-methoxy-4,4a-dihydronaphthalen-2-yl)-9,9-dimethylfluorene?
The InChIKey is AYGLFYWFJDBWOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H24O/c1-26(2)23-11-7-6-10-21(23)22-15-13-18(16-24(22)26)20-14-12-17-8-4-5-9-19(17)25(20)27-3/h4-11,13-17H,12H2,1-3H3.
What are the key properties of 2-(1-methoxy-4,4a-dihydronaphthalen-2-yl)-9,9-dimethylfluorene?
2-(1-methoxy-4,4a-dihydronaphthalen-2-yl)-9,9-dimethylfluorene has a molecular weight of 352.48 g/mol, XLogP of 6.42, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-methoxy-4,4a-dihydronaphthalen-2-yl)-9,9-dimethylfluorene is sourced from PubChem (CID 91099831), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).