spiro[benzo[b]fluorene-11,1'-cyclopentane]

C21H18 — CID 59806759

IUPACspiro[benzo[b]fluorene-11,1'-cyclopentane]
SMILESc1ccc2c(c1)-c1cc3ccccc3cc1C21CCCC1
InChIInChI=1S/C21H18/c1-2-8-16-14-20-18(13-15(16)7-1)17-9-3-4-10-19(17)21(20)11-5-6-12-21/h1-4,7-10,13-14H,5-6,11-12H2
InChIKeyGJIAAAGRZZACLU-UHFFFAOYSA-N
MW270.38 g/mol
LogP5.68
Rot. Bonds

About spiro[benzo[b]fluorene-11,1'-cyclopentane]

spiro[benzo[b]fluorene-11,1'-cyclopentane] (PubChem CID 59806759) has the molecular formula C21H18 and a molecular weight of 270.38 g/mol. Its IUPAC name is spiro[benzo[b]fluorene-11,1'-cyclopentane].

Molecular Properties

Compound Namespiro[benzo[b]fluorene-11,1'-cyclopentane]
PubChem CID59806759
Molecular FormulaC21H18
Molecular Weight270.38 g/mol
Exact Mass270.14
IUPAC Namespiro[benzo[b]fluorene-11,1'-cyclopentane]
SMILESc1ccc2c(c1)-c1cc3ccccc3cc1C21CCCC1
InChIInChI=1S/C21H18/c1-2-8-16-14-20-18(13-15(16)7-1)17-9-3-4-10-19(17)21(20)11-5-6-12-21/h1-4,7-10,13-14H,5-6,11-12H2
InChIKeyGJIAAAGRZZACLU-UHFFFAOYSA-N
XLogP5.68
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500270.38
LogP ≤ 55.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

2'-(6-spiro[cyclopentane-1,9'-fluorene]-2'-ylnaphthalen-2-yl)spiro[cyclopentane-1,9'-fluorene]
CID 58814373
8-naphthalen-2-yl-5-spiro[cyclopentane-1,9'-fluorene]-2'-ylbenzo[c]phenanthrene
CID 59282253
2,4,6-tri(spiro[cyclopentane-1,9'-fluorene]-2'-yl)pyrimidine
CID 71215635
2'-fluorospiro[cyclohexane-1,9'-fluorene]
CID 18740734
spiro[benzo[b]fluorene-11,9'-fluorene]
CID 140775185
2'-phenylspiro[cyclohexane-1,9'-fluorene]
CID 123183554
2'-tert-butylspiro[cyclohexane-1,9'-fluorene]
CID 168798514
3'-(4-methylphenyl)spiro[cyclopentane-1,9'-fluorene]
CID 58389877
2-phenyl-4-(4-phenylphenyl)-6-[4-(4-spiro[benzo[b]fluorene-11,1'-cyclohexane]-4-ylphenyl)phenyl]pyrimidine
CID 176793436
12',12'-dimethylspiro[cyclohexane-1,22'-hexacyclo[11.11.0.02,11.03,8.015,23.016,21]tetracosa-1(13),2(11),3,5,7,9,14,16,18,20,23-undecaene]
CID 164817979
4,6-diphenyl-2-(2-spiro[cyclohexane-1,9'-fluorene]-3'-ylphenyl)pyrimidine
CID 161402725
4,6-diphenyl-2-[4-(4-spiro[cyclohexane-1,9'-fluorene]-3'-ylphenyl)phenyl]pyrimidine
CID 146352227

Frequently Asked Questions

What is the IUPAC name of spiro[benzo[b]fluorene-11,1'-cyclopentane]?
The IUPAC name of spiro[benzo[b]fluorene-11,1'-cyclopentane] (CID 59806759) is spiro[benzo[b]fluorene-11,1'-cyclopentane].
What is the SMILES notation for spiro[benzo[b]fluorene-11,1'-cyclopentane]?
The canonical SMILES for spiro[benzo[b]fluorene-11,1'-cyclopentane] is c1ccc2c(c1)-c1cc3ccccc3cc1C21CCCC1.
What is the InChIKey of spiro[benzo[b]fluorene-11,1'-cyclopentane]?
The InChIKey is GJIAAAGRZZACLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H18/c1-2-8-16-14-20-18(13-15(16)7-1)17-9-3-4-10-19(17)21(20)11-5-6-12-21/h1-4,7-10,13-14H,5-6,11-12H2.
What are the key properties of spiro[benzo[b]fluorene-11,1'-cyclopentane]?
spiro[benzo[b]fluorene-11,1'-cyclopentane] has a molecular weight of 270.38 g/mol, XLogP of 5.68, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for spiro[benzo[b]fluorene-11,1'-cyclopentane] is sourced from PubChem (CID 59806759), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).