ethane;spiro[9H-anthracene-10,9'-fluorene]

C34H42 — CID 90717340

IUPACethane;spiro[9H-anthracene-10,9'-fluorene]
SMILESCC.CC.CC.CC.c1ccc2c(c1)Cc1ccccc1C21c2ccccc2-c2ccccc21
InChIInChI=1S/C26H18.4C2H6/c1-5-13-22-18(9-1)17-19-10-2-6-14-23(19)26(22)24-15-7-3-11-20(24)21-12-4-8-16-25(21)26;4*1-2/h1-16H,17H2;4*1-2H3
InChIKeyKCSHWKUHPUWZSA-UHFFFAOYSA-N
MW450.71 g/mol
LogP10.06
Rot. Bonds

About ethane;spiro[9H-anthracene-10,9'-fluorene]

ethane;spiro[9H-anthracene-10,9'-fluorene] (PubChem CID 90717340) has the molecular formula C34H42 and a molecular weight of 450.71 g/mol. Its IUPAC name is ethane;spiro[9H-anthracene-10,9'-fluorene].

Molecular Properties

Compound Nameethane;spiro[9H-anthracene-10,9'-fluorene]
PubChem CID90717340
Molecular FormulaC34H42
Molecular Weight450.71 g/mol
Exact Mass450.33
IUPAC Nameethane;spiro[9H-anthracene-10,9'-fluorene]
SMILESCC.CC.CC.CC.c1ccc2c(c1)Cc1ccccc1C21c2ccccc2-c2ccccc21
InChIInChI=1S/C26H18.4C2H6/c1-5-13-22-18(9-1)17-19-10-2-6-14-23(19)26(22)24-15-7-3-11-20(24)21-12-4-8-16-25(21)26;4*1-2/h1-16H,17H2;4*1-2H3
InChIKeyKCSHWKUHPUWZSA-UHFFFAOYSA-N
XLogP10.06
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms34
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500450.71
LogP ≤ 510.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

ethane;methane;10,10'-spirobi[9H-anthracene]
CID 157229277
butane;ethanamine;ethane;bis(spiro[9H-anthracene-10,9'-fluorene])
CID 165034994
3-tert-butylspiro[9H-anthracene-10,9'-fluorene]
CID 175918743
1-phenylpentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8,10,12(20),14,16,18-nonaene
CID 144907616
1'-bromospiro[9H-anthracene-10,9'-fluorene]
CID 142509759
ethane;naphthalene;9,9'-spirobi[fluorene]
CID 162036420
tris(6,12-dihydroindeno[1,2-b]fluorene);ethane;phenanthrene;bis(9,9'-spirobi[fluorene])
CID 161230311
bis(6,12-dihydroindeno[1,2-b]fluorene);ethane;bis(9H-fluorene);phenanthrene;bis(9,9'-spirobi[fluorene])
CID 161124439
1-[2'-[(dimethylamino)methyl]spiro[10H-anthracene-9,9'-fluorene]-2-yl]-N,N-dimethylmethanamine;1-[7'-[(dimethylamino)methyl]spiro[9H-anthracene-10,9'-fluorene]-2'-yl]-N,N-dimethylmethanamine;methane
CID 160791086
3'-methylspiro[9H-anthracene-10,11'-benzo[b]fluorene]
CID 142293757
ethane;9,9'-spirobi[fluorene];2,4,6-trimethyl-1,3,5-triazine
CID 161386785
CID 158369340
CID 158369340

Frequently Asked Questions

What is the IUPAC name of ethane;spiro[9H-anthracene-10,9'-fluorene]?
The IUPAC name of ethane;spiro[9H-anthracene-10,9'-fluorene] (CID 90717340) is ethane;spiro[9H-anthracene-10,9'-fluorene].
What is the SMILES notation for ethane;spiro[9H-anthracene-10,9'-fluorene]?
The canonical SMILES for ethane;spiro[9H-anthracene-10,9'-fluorene] is CC.CC.CC.CC.c1ccc2c(c1)Cc1ccccc1C21c2ccccc2-c2ccccc21.
What is the InChIKey of ethane;spiro[9H-anthracene-10,9'-fluorene]?
The InChIKey is KCSHWKUHPUWZSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H18.4C2H6/c1-5-13-22-18(9-1)17-19-10-2-6-14-23(19)26(22)24-15-7-3-11-20(24)21-12-4-8-16-25(21)26;4*1-2/h1-16H,17H2;4*1-2H3.
What are the key properties of ethane;spiro[9H-anthracene-10,9'-fluorene]?
ethane;spiro[9H-anthracene-10,9'-fluorene] has a molecular weight of 450.71 g/mol, XLogP of 10.06, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;spiro[9H-anthracene-10,9'-fluorene] is sourced from PubChem (CID 90717340), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).