7-(9,9-dimethylfluoren-2-yl)-10-phenylfluoranthene

C37H26 — CID 170668000

IUPAC7-(9,9-dimethylfluoren-2-yl)-10-phenylfluoranthene
SMILESCC1(C)c2ccccc2-c2ccc(-c3ccc(-c4ccccc4)c4c3-c3cccc5cccc-4c35)cc21
InChIInChI=1S/C37H26/c1-37(2)32-17-7-6-14-28(32)29-19-18-25(22-33(29)37)27-21-20-26(23-10-4-3-5-11-23)35-30-15-8-12-24-13-9-16-31(34(24)30)36(27)35/h3-22H,1-2H3
InChIKeyVHYZWNDKMKBDNU-UHFFFAOYSA-N
MW470.62 g/mol
LogP10.13
Rot. Bonds2

About 7-(9,9-dimethylfluoren-2-yl)-10-phenylfluoranthene

7-(9,9-dimethylfluoren-2-yl)-10-phenylfluoranthene (PubChem CID 170668000) has the molecular formula C37H26 and a molecular weight of 470.62 g/mol. Its IUPAC name is 7-(9,9-dimethylfluoren-2-yl)-10-phenylfluoranthene.

Molecular Properties

Compound Name7-(9,9-dimethylfluoren-2-yl)-10-phenylfluoranthene
PubChem CID170668000
Molecular FormulaC37H26
Molecular Weight470.62 g/mol
Exact Mass470.20
IUPAC Name7-(9,9-dimethylfluoren-2-yl)-10-phenylfluoranthene
SMILESCC1(C)c2ccccc2-c2ccc(-c3ccc(-c4ccccc4)c4c3-c3cccc5cccc-4c35)cc21
InChIInChI=1S/C37H26/c1-37(2)32-17-7-6-14-28(32)29-19-18-25(22-33(29)37)27-21-20-26(23-10-4-3-5-11-23)35-30-15-8-12-24-13-9-16-31(34(24)30)36(27)35/h3-22H,1-2H3
InChIKeyVHYZWNDKMKBDNU-UHFFFAOYSA-N
XLogP10.13
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms37
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500470.62
LogP ≤ 510.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

3,17-bis(9,9-dimethylfluoren-2-yl)-10,20-diphenylheptacyclo[13.9.2.02,11.04,9.012,25.016,21.022,26]hexacosa-1(25),2,4,6,8,10,12,14,16,18,20,22(26),23-tridecaene
CID 140722815
2-[9,9-dimethyl-7-(2-phenylphenyl)fluoren-2-yl]-7-[7-(2,6-diphenylphenyl)-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluorene
CID 58881185
2-[9,9-dimethyl-7-(2-phenylphenyl)fluoren-2-yl]-7-[7-(2,3-diphenylphenyl)-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluorene
CID 58881223
2-[4-[3-(9,9-dimethylfluoren-2-yl)-5-(4-phenylphenyl)phenyl]phenyl]pyrene
CID 123253774
12-(9,9-dimethylfluoren-2-yl)-7-naphthalen-1-ylbenzo[k]fluoranthene
CID 59404102
3-(9,9-dimethylfluoren-2-yl)-1,6-diphenylpyrene
CID 123577752
2',7'-bis(7,10-diphenylfluoranthen-8-yl)-9,9'-spirobi[fluorene]
CID 86040255
2-[2-(9,9-dimethylfluoren-2-yl)-3-phenylphenyl]-4,6-diphenylpyrimidine
CID 175459036
9-(9,9-dimethylfluoren-2-yl)-10-[7-[10-(9,9-dimethylfluoren-2-yl)-4-phenylanthracen-9-yl]-9,9-dimethylfluoren-2-yl]-1-phenylanthracene
CID 20822392
1-[7-[7-[7-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]pyrene
CID 123435588
3-[7-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-yl]-7,12-diphenylbenzo[k]fluoranthene
CID 58250850
6,6,12,12-tetramethyl-2-[6-(4-naphthalen-1-ylphenyl)pyren-1-yl]indeno[1,2-b]fluorene
CID 59390161

Frequently Asked Questions

What is the IUPAC name of 7-(9,9-dimethylfluoren-2-yl)-10-phenylfluoranthene?
The IUPAC name of 7-(9,9-dimethylfluoren-2-yl)-10-phenylfluoranthene (CID 170668000) is 7-(9,9-dimethylfluoren-2-yl)-10-phenylfluoranthene.
What is the SMILES notation for 7-(9,9-dimethylfluoren-2-yl)-10-phenylfluoranthene?
The canonical SMILES for 7-(9,9-dimethylfluoren-2-yl)-10-phenylfluoranthene is CC1(C)c2ccccc2-c2ccc(-c3ccc(-c4ccccc4)c4c3-c3cccc5cccc-4c35)cc21.
What is the InChIKey of 7-(9,9-dimethylfluoren-2-yl)-10-phenylfluoranthene?
The InChIKey is VHYZWNDKMKBDNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C37H26/c1-37(2)32-17-7-6-14-28(32)29-19-18-25(22-33(29)37)27-21-20-26(23-10-4-3-5-11-23)35-30-15-8-12-24-13-9-16-31(34(24)30)36(27)35/h3-22H,1-2H3.
What are the key properties of 7-(9,9-dimethylfluoren-2-yl)-10-phenylfluoranthene?
7-(9,9-dimethylfluoren-2-yl)-10-phenylfluoranthene has a molecular weight of 470.62 g/mol, XLogP of 10.13, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(9,9-dimethylfluoren-2-yl)-10-phenylfluoranthene is sourced from PubChem (CID 170668000), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).