(2-butyl-2,7-dimethyl-6-trimethylsilylfluoren-3-yl)-trimethylsilane

C25H38Si2 — CID 87102515

IUPAC(2-butyl-2,7-dimethyl-6-trimethylsilylfluoren-3-yl)-trimethylsilane
SMILESCCCCC1(C)C=C2C=c3cc(C)c([Si](C)(C)C)cc3=C2C=C1[Si](C)(C)C
InChIInChI=1S/C25H38Si2/c1-10-11-12-25(3)17-20-14-19-13-18(2)23(26(4,5)6)15-21(19)22(20)16-24(25)27(7,8)9/h13-17H,10-12H2,1-9H3
InChIKeyPSWAATFVPJBJIH-UHFFFAOYSA-N
MW394.75 g/mol
LogP5.43
Rot. Bonds5

About (2-butyl-2,7-dimethyl-6-trimethylsilylfluoren-3-yl)-trimethylsilane

(2-butyl-2,7-dimethyl-6-trimethylsilylfluoren-3-yl)-trimethylsilane (PubChem CID 87102515) has the molecular formula C25H38Si2 and a molecular weight of 394.75 g/mol. Its IUPAC name is (2-butyl-2,7-dimethyl-6-trimethylsilylfluoren-3-yl)-trimethylsilane.

Molecular Properties

Compound Name(2-butyl-2,7-dimethyl-6-trimethylsilylfluoren-3-yl)-trimethylsilane
PubChem CID87102515
Molecular FormulaC25H38Si2
Molecular Weight394.75 g/mol
Exact Mass394.25
IUPAC Name(2-butyl-2,7-dimethyl-6-trimethylsilylfluoren-3-yl)-trimethylsilane
SMILESCCCCC1(C)C=C2C=c3cc(C)c([Si](C)(C)C)cc3=C2C=C1[Si](C)(C)C
InChIInChI=1S/C25H38Si2/c1-10-11-12-25(3)17-20-14-19-13-18(2)23(26(4,5)6)15-21(19)22(20)16-24(25)27(7,8)9/h13-17H,10-12H2,1-9H3
InChIKeyPSWAATFVPJBJIH-UHFFFAOYSA-N
XLogP5.43
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500394.75
LogP ≤ 55.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (2-butyl-2,7-dimethyl-6-trimethylsilylfluoren-3-yl)-trimethylsilane?
The IUPAC name of (2-butyl-2,7-dimethyl-6-trimethylsilylfluoren-3-yl)-trimethylsilane (CID 87102515) is (2-butyl-2,7-dimethyl-6-trimethylsilylfluoren-3-yl)-trimethylsilane.
What is the SMILES notation for (2-butyl-2,7-dimethyl-6-trimethylsilylfluoren-3-yl)-trimethylsilane?
The canonical SMILES for (2-butyl-2,7-dimethyl-6-trimethylsilylfluoren-3-yl)-trimethylsilane is CCCCC1(C)C=C2C=c3cc(C)c([Si](C)(C)C)cc3=C2C=C1[Si](C)(C)C.
What is the InChIKey of (2-butyl-2,7-dimethyl-6-trimethylsilylfluoren-3-yl)-trimethylsilane?
The InChIKey is PSWAATFVPJBJIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H38Si2/c1-10-11-12-25(3)17-20-14-19-13-18(2)23(26(4,5)6)15-21(19)22(20)16-24(25)27(7,8)9/h13-17H,10-12H2,1-9H3.
What are the key properties of (2-butyl-2,7-dimethyl-6-trimethylsilylfluoren-3-yl)-trimethylsilane?
(2-butyl-2,7-dimethyl-6-trimethylsilylfluoren-3-yl)-trimethylsilane has a molecular weight of 394.75 g/mol, XLogP of 5.43, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (2-butyl-2,7-dimethyl-6-trimethylsilylfluoren-3-yl)-trimethylsilane is sourced from PubChem (CID 87102515), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).