2',3'-bis(ethenyl)-2-methylspiro[fluorene-9,1'-indene];ethane;methane

C29H30 — CID 163299187

IUPAC2',3'-bis(ethenyl)-2-methylspiro[fluorene-9,1'-indene];ethane;methane
SMILESC.C=CC1=C(C=C)C2(c3ccccc31)c1ccccc1-c1ccc(C)cc12.CC
InChIInChI=1S/C26H20.C2H6.CH4/c1-4-18-19-10-6-8-12-23(19)26(22(18)5-2)24-13-9-7-11-20(24)21-15-14-17(3)16-25(21)26;1-2;/h4-16H,1-2H2,3H3;1-2H3;1H4
InChIKeyUHRMXIPFFSEQFY-UHFFFAOYSA-N
MW378.56 g/mol
LogP8.11
Rot. Bonds2

About 2',3'-bis(ethenyl)-2-methylspiro[fluorene-9,1'-indene];ethane;methane

2',3'-bis(ethenyl)-2-methylspiro[fluorene-9,1'-indene];ethane;methane (PubChem CID 163299187) has the molecular formula C29H30 and a molecular weight of 378.56 g/mol. Its IUPAC name is 2',3'-bis(ethenyl)-2-methylspiro[fluorene-9,1'-indene];ethane;methane.

Molecular Properties

Compound Name2',3'-bis(ethenyl)-2-methylspiro[fluorene-9,1'-indene];ethane;methane
PubChem CID163299187
Molecular FormulaC29H30
Molecular Weight378.56 g/mol
Exact Mass378.23
IUPAC Name2',3'-bis(ethenyl)-2-methylspiro[fluorene-9,1'-indene];ethane;methane
SMILESC.C=CC1=C(C=C)C2(c3ccccc31)c1ccccc1-c1ccc(C)cc12.CC
InChIInChI=1S/C26H20.C2H6.CH4/c1-4-18-19-10-6-8-12-23(19)26(22(18)5-2)24-13-9-7-11-20(24)21-15-14-17(3)16-25(21)26;1-2;/h4-16H,1-2H2,3H3;1-2H3;1H4
InChIKeyUHRMXIPFFSEQFY-UHFFFAOYSA-N
XLogP8.11
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500378.56
LogP ≤ 58.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 2',3'-bis(ethenyl)-2-methylspiro[fluorene-9,1'-indene];ethane;methane?
The IUPAC name of 2',3'-bis(ethenyl)-2-methylspiro[fluorene-9,1'-indene];ethane;methane (CID 163299187) is 2',3'-bis(ethenyl)-2-methylspiro[fluorene-9,1'-indene];ethane;methane.
What is the SMILES notation for 2',3'-bis(ethenyl)-2-methylspiro[fluorene-9,1'-indene];ethane;methane?
The canonical SMILES for 2',3'-bis(ethenyl)-2-methylspiro[fluorene-9,1'-indene];ethane;methane is C.C=CC1=C(C=C)C2(c3ccccc31)c1ccccc1-c1ccc(C)cc12.CC.
What is the InChIKey of 2',3'-bis(ethenyl)-2-methylspiro[fluorene-9,1'-indene];ethane;methane?
The InChIKey is UHRMXIPFFSEQFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H20.C2H6.CH4/c1-4-18-19-10-6-8-12-23(19)26(22(18)5-2)24-13-9-7-11-20(24)21-15-14-17(3)16-25(21)26;1-2;/h4-16H,1-2H2,3H3;1-2H3;1H4.
What are the key properties of 2',3'-bis(ethenyl)-2-methylspiro[fluorene-9,1'-indene];ethane;methane?
2',3'-bis(ethenyl)-2-methylspiro[fluorene-9,1'-indene];ethane;methane has a molecular weight of 378.56 g/mol, XLogP of 8.11, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2',3'-bis(ethenyl)-2-methylspiro[fluorene-9,1'-indene];ethane;methane is sourced from PubChem (CID 163299187), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).