1',8'-diphenylspiro[cyclopentane-1,9'-fluorene];3',6'-diphenylspiro[cyclopentane-1,9'-fluorene];3',6'-diphenylspiro[1,3-dihydroindene-2,9'-fluorene];ethane;1',3',6',8'-tetraphenylspiro[cyclopentane-1,9'-fluorene]

C142H134 — CID 157275774

IUPAC1',8'-diphenylspiro[cyclopentane-1,9'-fluorene];3',6'-diphenylspiro[cyclopentane-1,9'-fluorene];3',6'-diphenylspiro[1,3-dihydroindene-2,9'-fluorene];ethane;1',3',6',8'-tetraphenylspiro[cyclopentane-1,9'-fluorene]
SMILESCC.CC.CC.CC.CC.c1ccc(-c2cc(-c3ccccc3)c3c(c2)-c2cc(-c4ccccc4)cc(-c4ccccc4)c2C32CCCC2)cc1.c1ccc(-c2ccc3c(c2)-c2cc(-c4ccccc4)ccc2C32CCCC2)cc1.c1ccc(-c2ccc3c(c2)-c2cc(-c4ccccc4)ccc2C32Cc3ccccc3C2)cc1.c1ccc(-c2cccc3c2C2(CCCC2)c2c(-c4ccccc4)cccc2-3)cc1
InChIInChI=1S/C41H32.C33H24.2C29H24.5C2H6/c1-5-15-29(16-6-1)33-25-35(31-19-9-3-10-20-31)39-37(27-33)38-28-34(30-17-7-2-8-18-30)26-36(32-21-11-4-12-22-32)40(38)41(39)23-13-14-24-41;1-3-9-23(10-4-1)25-15-17-31-29(19-25)30-20-26(24-11-5-2-6-12-24)16-18-32(30)33(31)21-27-13-7-8-14-28(27)22-33;1-3-11-21(12-4-1)23-15-9-17-25-26-18-10-16-24(22-13-5-2-6-14-22)28(26)29(27(23)25)19-7-8-20-29;1-3-9-21(10-4-1)23-13-15-27-25(19-23)26-20-24(22-11-5-2-6-12-22)14-16-28(26)29(27)17-7-8-18-29;5*1-2/h1-12,15-22,25-28H,13-14,23-24H2;1-20H,21-22H2;1-6,9-18H,7-8,19-20H2;1-6,9-16,19-20H,7-8,17-18H2;5*1-2H3
InChIKeyAZBRLPZEIMYIEW-UHFFFAOYSA-N
MW1840.63 g/mol
LogP40.13
Rot. Bonds10

About 1',8'-diphenylspiro[cyclopentane-1,9'-fluorene];3',6'-diphenylspiro[cyclopentane-1,9'-fluorene];3',6'-diphenylspiro[1,3-dihydroindene-2,9'-fluorene];ethane;1',3',6',8'-tetraphenylspiro[cyclopentane-1,9'-fluorene]

1',8'-diphenylspiro[cyclopentane-1,9'-fluorene];3',6'-diphenylspiro[cyclopentane-1,9'-fluorene];3',6'-diphenylspiro[1,3-dihydroindene-2,9'-fluorene];ethane;1',3',6',8'-tetraphenylspiro[cyclopentane-1,9'-fluorene] (PubChem CID 157275774) has the molecular formula C142H134 and a molecular weight of 1840.63 g/mol. Its IUPAC name is 1',8'-diphenylspiro[cyclopentane-1,9'-fluorene];3',6'-diphenylspiro[cyclopentane-1,9'-fluorene];3',6'-diphenylspiro[1,3-dihydroindene-2,9'-fluorene];ethane;1',3',6',8'-tetraphenylspiro[cyclopentane-1,9'-fluorene].

Molecular Properties

Compound Name1',8'-diphenylspiro[cyclopentane-1,9'-fluorene];3',6'-diphenylspiro[cyclopentane-1,9'-fluorene];3',6'-diphenylspiro[1,3-dihydroindene-2,9'-fluorene];ethane;1',3',6',8'-tetraphenylspiro[cyclopentane-1,9'-fluorene]
PubChem CID157275774
Molecular FormulaC142H134
Molecular Weight1840.63 g/mol
Exact Mass1839.05
IUPAC Name1',8'-diphenylspiro[cyclopentane-1,9'-fluorene];3',6'-diphenylspiro[cyclopentane-1,9'-fluorene];3',6'-diphenylspiro[1,3-dihydroindene-2,9'-fluorene];ethane;1',3',6',8'-tetraphenylspiro[cyclopentane-1,9'-fluorene]
SMILESCC.CC.CC.CC.CC.c1ccc(-c2cc(-c3ccccc3)c3c(c2)-c2cc(-c4ccccc4)cc(-c4ccccc4)c2C32CCCC2)cc1.c1ccc(-c2ccc3c(c2)-c2cc(-c4ccccc4)ccc2C32CCCC2)cc1.c1ccc(-c2ccc3c(c2)-c2cc(-c4ccccc4)ccc2C32Cc3ccccc3C2)cc1.c1ccc(-c2cccc3c2C2(CCCC2)c2c(-c4ccccc4)cccc2-3)cc1
InChIInChI=1S/C41H32.C33H24.2C29H24.5C2H6/c1-5-15-29(16-6-1)33-25-35(31-19-9-3-10-20-31)39-37(27-33)38-28-34(30-17-7-2-8-18-30)26-36(32-21-11-4-12-22-32)40(38)41(39)23-13-14-24-41;1-3-9-23(10-4-1)25-15-17-31-29(19-25)30-20-26(24-11-5-2-6-12-24)16-18-32(30)33(31)21-27-13-7-8-14-28(27)22-33;1-3-11-21(12-4-1)23-15-9-17-25-26-18-10-16-24(22-13-5-2-6-14-22)28(26)29(27(23)25)19-7-8-20-29;1-3-9-21(10-4-1)23-13-15-27-25(19-23)26-20-24(22-11-5-2-6-12-22)14-16-28(26)29(27)17-7-8-18-29;5*1-2/h1-12,15-22,25-28H,13-14,23-24H2;1-20H,21-22H2;1-6,9-18H,7-8,19-20H2;1-6,9-16,19-20H,7-8,17-18H2;5*1-2H3
InChIKeyAZBRLPZEIMYIEW-UHFFFAOYSA-N
XLogP40.13
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds10
Heavy Atoms142
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001840.63
LogP ≤ 540.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze 1',8'-diphenylspiro[cyclopentane-1,9'-fluorene];3',6'-diphenylspiro[cyclopentane-1,9'-fluorene];3',6'-diphenylspiro[1,3-dihydroindene-2,9'-fluorene];ethane;1',3',6',8'-tetraphenylspiro[cyclopentane-1,9'-fluorene] with MolForge

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Frequently Asked Questions

What is the IUPAC name of 1',8'-diphenylspiro[cyclopentane-1,9'-fluorene];3',6'-diphenylspiro[cyclopentane-1,9'-fluorene];3',6'-diphenylspiro[1,3-dihydroindene-2,9'-fluorene];ethane;1',3',6',8'-tetraphenylspiro[cyclopentane-1,9'-fluorene]?
The IUPAC name of 1',8'-diphenylspiro[cyclopentane-1,9'-fluorene];3',6'-diphenylspiro[cyclopentane-1,9'-fluorene];3',6'-diphenylspiro[1,3-dihydroindene-2,9'-fluorene];ethane;1',3',6',8'-tetraphenylspiro[cyclopentane-1,9'-fluorene] (CID 157275774) is 1',8'-diphenylspiro[cyclopentane-1,9'-fluorene];3',6'-diphenylspiro[cyclopentane-1,9'-fluorene];3',6'-diphenylspiro[1,3-dihydroindene-2,9'-fluorene];ethane;1',3',6',8'-tetraphenylspiro[cyclopentane-1,9'-fluorene].
What is the SMILES notation for 1',8'-diphenylspiro[cyclopentane-1,9'-fluorene];3',6'-diphenylspiro[cyclopentane-1,9'-fluorene];3',6'-diphenylspiro[1,3-dihydroindene-2,9'-fluorene];ethane;1',3',6',8'-tetraphenylspiro[cyclopentane-1,9'-fluorene]?
The canonical SMILES for 1',8'-diphenylspiro[cyclopentane-1,9'-fluorene];3',6'-diphenylspiro[cyclopentane-1,9'-fluorene];3',6'-diphenylspiro[1,3-dihydroindene-2,9'-fluorene];ethane;1',3',6',8'-tetraphenylspiro[cyclopentane-1,9'-fluorene] is CC.CC.CC.CC.CC.c1ccc(-c2cc(-c3ccccc3)c3c(c2)-c2cc(-c4ccccc4)cc(-c4ccccc4)c2C32CCCC2)cc1.c1ccc(-c2ccc3c(c2)-c2cc(-c4ccccc4)ccc2C32CCCC2)cc1.c1ccc(-c2ccc3c(c2)-c2cc(-c4ccccc4)ccc2C32Cc3ccccc3C2)cc1.c1ccc(-c2cccc3c2C2(CCCC2)c2c(-c4ccccc4)cccc2-3)cc1.
What is the InChIKey of 1',8'-diphenylspiro[cyclopentane-1,9'-fluorene];3',6'-diphenylspiro[cyclopentane-1,9'-fluorene];3',6'-diphenylspiro[1,3-dihydroindene-2,9'-fluorene];ethane;1',3',6',8'-tetraphenylspiro[cyclopentane-1,9'-fluorene]?
The InChIKey is AZBRLPZEIMYIEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C41H32.C33H24.2C29H24.5C2H6/c1-5-15-29(16-6-1)33-25-35(31-19-9-3-10-20-31)39-37(27-33)38-28-34(30-17-7-2-8-18-30)26-36(32-21-11-4-12-22-32)40(38)41(39)23-13-14-24-41;1-3-9-23(10-4-1)25-15-17-31-29(19-25)30-20-26(24-11-5-2-6-12-24)16-18-32(30)33(31)21-27-13-7-8-14-28(27)22-33;1-3-11-21(12-4-1)23-15-9-17-25-26-18-10-16-24(22-13-5-2-6-14-22)28(26)29(27(23)25)19-7-8-20-29;1-3-9-21(10-4-1)23-13-15-27-25(19-23)26-20-24(22-11-5-2-6-12-22)14-16-28(26)29(27)17-7-8-18-29;5*1-2/h1-12,15-22,25-28H,13-14,23-24H2;1-20H,21-22H2;1-6,9-18H,7-8,19-20H2;1-6,9-16,19-20H,7-8,17-18H2;5*1-2H3.
What are the key properties of 1',8'-diphenylspiro[cyclopentane-1,9'-fluorene];3',6'-diphenylspiro[cyclopentane-1,9'-fluorene];3',6'-diphenylspiro[1,3-dihydroindene-2,9'-fluorene];ethane;1',3',6',8'-tetraphenylspiro[cyclopentane-1,9'-fluorene]?
1',8'-diphenylspiro[cyclopentane-1,9'-fluorene];3',6'-diphenylspiro[cyclopentane-1,9'-fluorene];3',6'-diphenylspiro[1,3-dihydroindene-2,9'-fluorene];ethane;1',3',6',8'-tetraphenylspiro[cyclopentane-1,9'-fluorene] has a molecular weight of 1840.63 g/mol, XLogP of 40.13, 10 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1',8'-diphenylspiro[cyclopentane-1,9'-fluorene];3',6'-diphenylspiro[cyclopentane-1,9'-fluorene];3',6'-diphenylspiro[1,3-dihydroindene-2,9'-fluorene];ethane;1',3',6',8'-tetraphenylspiro[cyclopentane-1,9'-fluorene] is sourced from PubChem (CID 157275774), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).