7-(9,9-dimethylfluoren-3-yl)-10-(9,9-diphenylfluoren-3-yl)benzo[c]phenoxazine

C56H39NO — CID 155791237

IUPAC7-(9,9-dimethylfluoren-3-yl)-10-(9,9-diphenylfluoren-3-yl)benzo[c]phenoxazine
SMILESCC1(C)c2ccccc2-c2cc(N3c4ccc(-c5ccc6c(c5)-c5ccccc5C6(c5ccccc5)c5ccccc5)cc4Oc4c3ccc3ccccc43)ccc21
InChIInChI=1S/C56H39NO/c1-55(2)47-23-13-11-21-43(47)46-35-41(28-30-48(46)55)57-51-31-27-38(34-53(51)58-54-42-20-10-9-15-36(42)26-32-52(54)57)37-25-29-50-45(33-37)44-22-12-14-24-49(44)56(50,39-16-5-3-6-17-39)40-18-7-4-8-19-40/h3-35H,1-2H3
InChIKeyGXQYLLWWIMUXEX-UHFFFAOYSA-N
MW741.93 g/mol
LogP14.75
Rot. Bonds4

About 7-(9,9-dimethylfluoren-3-yl)-10-(9,9-diphenylfluoren-3-yl)benzo[c]phenoxazine

7-(9,9-dimethylfluoren-3-yl)-10-(9,9-diphenylfluoren-3-yl)benzo[c]phenoxazine (PubChem CID 155791237) has the molecular formula C56H39NO and a molecular weight of 741.93 g/mol. Its IUPAC name is 7-(9,9-dimethylfluoren-3-yl)-10-(9,9-diphenylfluoren-3-yl)benzo[c]phenoxazine.

Molecular Properties

Compound Name7-(9,9-dimethylfluoren-3-yl)-10-(9,9-diphenylfluoren-3-yl)benzo[c]phenoxazine
PubChem CID155791237
Molecular FormulaC56H39NO
Molecular Weight741.93 g/mol
Exact Mass741.30
IUPAC Name7-(9,9-dimethylfluoren-3-yl)-10-(9,9-diphenylfluoren-3-yl)benzo[c]phenoxazine
SMILESCC1(C)c2ccccc2-c2cc(N3c4ccc(-c5ccc6c(c5)-c5ccccc5C6(c5ccccc5)c5ccccc5)cc4Oc4c3ccc3ccccc43)ccc21
InChIInChI=1S/C56H39NO/c1-55(2)47-23-13-11-21-43(47)46-35-41(28-30-48(46)55)57-51-31-27-38(34-53(51)58-54-42-20-10-9-15-36(42)26-32-52(54)57)37-25-29-50-45(33-37)44-22-12-14-24-49(44)56(50,39-16-5-3-6-17-39)40-18-7-4-8-19-40/h3-35H,1-2H3
InChIKeyGXQYLLWWIMUXEX-UHFFFAOYSA-N
XLogP14.75
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms58
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500741.93
LogP ≤ 514.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

9-(11,11-diphenylbenzo[b]fluoren-2-yl)spiro[benzo[c]xanthene-7,9'-fluorene]
CID 170027656
4-(9,9-dimethylfluoren-3-yl)-9,9-diphenylxanthene
CID 170018659
14-[7-(9,9-dimethylacridin-10-yl)phenanthren-2-yl]-10,10-diphenyl-21-oxa-14-azapentacyclo[11.8.0.03,11.04,9.015,20]henicosa-1(13),2,4,6,8,11,15,17,19-nonaene
CID 146213167
9-(12,12-dimethyl-7-phenylbenzo[a]acridin-9-yl)-7-phenylbenzo[c]phenoxazine
CID 155791211
9,9-dimethyl-2,7-diphenyl-10-[4-(9,9'-spirobi[fluorene]-3-yl)phenyl]acridine
CID 168750142
10-spiro[2-oxapentacyclo[12.8.0.03,12.04,9.017,22]docosa-1(14),3(12),4,6,8,10,15,17,19,21-decaene-13,9'-fluorene]-2'-ylphenoxazine
CID 135229425
9,9-dimethyl-4-[3-(7-phenylbenzo[c]fluoren-7-yl)phenyl]xanthene
CID 170029425
9-[2-(9-phenylfluoren-9-yl)phenyl]spiro[benzo[c]xanthene-7,9'-fluorene]
CID 170023018
7-(9,9-dimethylfluoren-3-yl)-10-(9,9-diphenylfluoren-3-yl)benzo[c]phenoxazine;9-(5,5-diphenylbenzo[b][1]benzosilol-2-yl)-7-naphthalen-1-ylbenzo[c]phenothiazine;2-[9-(3,5-diphenylphenyl)carbazol-3-yl]-11-(3-phenylphenyl)-12H-benzo[b]phenothiazine;2-(9-naphthalen-1-ylcarbazol-3-yl)-12-(3-naphthalen-1-ylphenyl)benzo[b]phenoxazine
CID 157153861
10-[14-(9,9-dimethylfluoren-2-yl)-14-azatetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8(13),9,11,15,17-nonaen-10-yl]-14-naphthalen-2-yl-14-azatetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8(13),9,11,15,17-nonaene
CID 122659751
3-[9-(9,9-dimethylfluoren-2-yl)carbazol-3-yl]-9-naphthalen-2-ylcarbazole;3-[9-(9,9-diphenylfluoren-2-yl)carbazol-3-yl]-9-naphthalen-2-ylcarbazole
CID 157226629
5,8,8-triphenyl-3-(9-phenylcarbazol-3-yl)indeno[2,1-c]phenoxazine
CID 118668301

Frequently Asked Questions

What is the IUPAC name of 7-(9,9-dimethylfluoren-3-yl)-10-(9,9-diphenylfluoren-3-yl)benzo[c]phenoxazine?
The IUPAC name of 7-(9,9-dimethylfluoren-3-yl)-10-(9,9-diphenylfluoren-3-yl)benzo[c]phenoxazine (CID 155791237) is 7-(9,9-dimethylfluoren-3-yl)-10-(9,9-diphenylfluoren-3-yl)benzo[c]phenoxazine.
What is the SMILES notation for 7-(9,9-dimethylfluoren-3-yl)-10-(9,9-diphenylfluoren-3-yl)benzo[c]phenoxazine?
The canonical SMILES for 7-(9,9-dimethylfluoren-3-yl)-10-(9,9-diphenylfluoren-3-yl)benzo[c]phenoxazine is CC1(C)c2ccccc2-c2cc(N3c4ccc(-c5ccc6c(c5)-c5ccccc5C6(c5ccccc5)c5ccccc5)cc4Oc4c3ccc3ccccc43)ccc21.
What is the InChIKey of 7-(9,9-dimethylfluoren-3-yl)-10-(9,9-diphenylfluoren-3-yl)benzo[c]phenoxazine?
The InChIKey is GXQYLLWWIMUXEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C56H39NO/c1-55(2)47-23-13-11-21-43(47)46-35-41(28-30-48(46)55)57-51-31-27-38(34-53(51)58-54-42-20-10-9-15-36(42)26-32-52(54)57)37-25-29-50-45(33-37)44-22-12-14-24-49(44)56(50,39-16-5-3-6-17-39)40-18-7-4-8-19-40/h3-35H,1-2H3.
What are the key properties of 7-(9,9-dimethylfluoren-3-yl)-10-(9,9-diphenylfluoren-3-yl)benzo[c]phenoxazine?
7-(9,9-dimethylfluoren-3-yl)-10-(9,9-diphenylfluoren-3-yl)benzo[c]phenoxazine has a molecular weight of 741.93 g/mol, XLogP of 14.75, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(9,9-dimethylfluoren-3-yl)-10-(9,9-diphenylfluoren-3-yl)benzo[c]phenoxazine is sourced from PubChem (CID 155791237), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).