9',17'-dimethylspiro[fluorene-9,14'-tetracyclo[13.4.0.02,7.08,13]nonadeca-1(15),2,4,6,8,10,12,16,18-nonaene]

C33H24 — CID 160896143

IUPAC9',17'-dimethylspiro[fluorene-9,14'-tetracyclo[13.4.0.02,7.08,13]nonadeca-1(15),2,4,6,8,10,12,16,18-nonaene]
SMILESCc1ccc2c(c1)C1(c3ccccc3-c3ccccc31)c1cccc(C)c1-c1ccccc1-2
InChIInChI=1S/C33H24/c1-21-18-19-26-23-11-3-4-14-27(23)32-22(2)10-9-17-30(32)33(31(26)20-21)28-15-7-5-12-24(28)25-13-6-8-16-29(25)33/h3-20H,1-2H3
InChIKeyHTOIPVDKKJFRQV-UHFFFAOYSA-N
MW420.56 g/mol
LogP8.31
Rot. Bonds

About 9',17'-dimethylspiro[fluorene-9,14'-tetracyclo[13.4.0.02,7.08,13]nonadeca-1(15),2,4,6,8,10,12,16,18-nonaene]

9',17'-dimethylspiro[fluorene-9,14'-tetracyclo[13.4.0.02,7.08,13]nonadeca-1(15),2,4,6,8,10,12,16,18-nonaene] (PubChem CID 160896143) has the molecular formula C33H24 and a molecular weight of 420.56 g/mol. Its IUPAC name is 9',17'-dimethylspiro[fluorene-9,14'-tetracyclo[13.4.0.02,7.08,13]nonadeca-1(15),2,4,6,8,10,12,16,18-nonaene].

Molecular Properties

Compound Name9',17'-dimethylspiro[fluorene-9,14'-tetracyclo[13.4.0.02,7.08,13]nonadeca-1(15),2,4,6,8,10,12,16,18-nonaene]
PubChem CID160896143
Molecular FormulaC33H24
Molecular Weight420.56 g/mol
Exact Mass420.19
IUPAC Name9',17'-dimethylspiro[fluorene-9,14'-tetracyclo[13.4.0.02,7.08,13]nonadeca-1(15),2,4,6,8,10,12,16,18-nonaene]
SMILESCc1ccc2c(c1)C1(c3ccccc3-c3ccccc31)c1cccc(C)c1-c1ccccc1-2
InChIInChI=1S/C33H24/c1-21-18-19-26-23-11-3-4-14-27(23)32-22(2)10-9-17-30(32)33(31(26)20-21)28-15-7-5-12-24(28)25-13-6-8-16-29(25)33/h3-20H,1-2H3
InChIKeyHTOIPVDKKJFRQV-UHFFFAOYSA-N
XLogP8.31
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms33
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500420.56
LogP ≤ 58.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze 9',17'-dimethylspiro[fluorene-9,14'-tetracyclo[13.4.0.02,7.08,13]nonadeca-1(15),2,4,6,8,10,12,16,18-nonaene] with MolForge

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Related Compounds

2-methyl-9,9'-spirobi[fluorene];bis(4'-methyl-9,9'-spirobi[fluorene])
CID 158761183
3,4'-dimethyl-9,9'-spirobi[fluorene]
CID 145204038
2,2',7'-trimethyl-9,9'-spirobi[fluorene]
CID 20807057
2-methyl-9,9-diphenylfluorene;3-methyl-9,9-diphenylfluorene;bis(4-methyl-9,9-diphenylfluorene)
CID 160627919
4'-methyl-9,9'-spirobi[fluorene]
CID 91359179
2-methyl-2'-[4-[(5'-methyl-9,9'-spirobi[fluorene]-2'-yl)sulfinyl]phenyl]sulfinyl-9,9'-spirobi[fluorene]
CID 134550597
CID 58607554
CID 58607554
4,5-dimethyl-9H-fluorene;2,2'-dimethyl-9,9'-spirobi[fluorene];2',7'-dimethyl-9,9'-spirobi[fluorene];3,3'-dimethyl-9,9'-spirobi[fluorene];3,6-dimethyl-9,9'-spirobi[fluorene];ethane
CID 161481336
2,6-dimethyl-9,9'-spirobi[fluorene];3,3'-dimethyl-9,9'-spirobi[fluorene];ethane
CID 159071810
2',9,9-trimethylspiro[anthracene-10,9'-fluorene]
CID 142504500
2-methyl-9,9-diphenylfluorene;3-methyl-9,9-diphenylfluorene;4-methyl-9,9-diphenylfluorene;2,9,9-trimethylfluorene;3,9,9-trimethylfluorene;4,9,9-trimethylfluorene
CID 159829393
2-methyl-9,9-diphenylfluorene;3-methyl-9,9-diphenylfluorene;bis(4-methyl-9,9-diphenylfluorene);1,9,9-trimethylfluorene
CID 159806985

Frequently Asked Questions

What is the IUPAC name of 9',17'-dimethylspiro[fluorene-9,14'-tetracyclo[13.4.0.02,7.08,13]nonadeca-1(15),2,4,6,8,10,12,16,18-nonaene]?
The IUPAC name of 9',17'-dimethylspiro[fluorene-9,14'-tetracyclo[13.4.0.02,7.08,13]nonadeca-1(15),2,4,6,8,10,12,16,18-nonaene] (CID 160896143) is 9',17'-dimethylspiro[fluorene-9,14'-tetracyclo[13.4.0.02,7.08,13]nonadeca-1(15),2,4,6,8,10,12,16,18-nonaene].
What is the SMILES notation for 9',17'-dimethylspiro[fluorene-9,14'-tetracyclo[13.4.0.02,7.08,13]nonadeca-1(15),2,4,6,8,10,12,16,18-nonaene]?
The canonical SMILES for 9',17'-dimethylspiro[fluorene-9,14'-tetracyclo[13.4.0.02,7.08,13]nonadeca-1(15),2,4,6,8,10,12,16,18-nonaene] is Cc1ccc2c(c1)C1(c3ccccc3-c3ccccc31)c1cccc(C)c1-c1ccccc1-2.
What is the InChIKey of 9',17'-dimethylspiro[fluorene-9,14'-tetracyclo[13.4.0.02,7.08,13]nonadeca-1(15),2,4,6,8,10,12,16,18-nonaene]?
The InChIKey is HTOIPVDKKJFRQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C33H24/c1-21-18-19-26-23-11-3-4-14-27(23)32-22(2)10-9-17-30(32)33(31(26)20-21)28-15-7-5-12-24(28)25-13-6-8-16-29(25)33/h3-20H,1-2H3.
What are the key properties of 9',17'-dimethylspiro[fluorene-9,14'-tetracyclo[13.4.0.02,7.08,13]nonadeca-1(15),2,4,6,8,10,12,16,18-nonaene]?
9',17'-dimethylspiro[fluorene-9,14'-tetracyclo[13.4.0.02,7.08,13]nonadeca-1(15),2,4,6,8,10,12,16,18-nonaene] has a molecular weight of 420.56 g/mol, XLogP of 8.31, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 9',17'-dimethylspiro[fluorene-9,14'-tetracyclo[13.4.0.02,7.08,13]nonadeca-1(15),2,4,6,8,10,12,16,18-nonaene] is sourced from PubChem (CID 160896143), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).