5-ethenyl-1,1,2,2,3,3-hexamethyl-4-[(Z)-prop-1-enyl]thiophene

C15H26S — CID 154981940

IUPAC5-ethenyl-1,1,2,2,3,3-hexamethyl-4-[(Z)-prop-1-enyl]thiophene
SMILESC=CC1=C(/C=C\C)C(C)(C)C(C)(C)S1(C)C
InChIInChI=1S/C15H26S/c1-9-11-12-13(10-2)16(7,8)15(5,6)14(12,3)4/h9-11H,2H2,1,3-8H3/b11-9-
InChIKeyXXHSGHKQQIKVEK-LUAWRHEFSA-N
MW238.44 g/mol
LogP4.89
Rot. Bonds2

About 5-ethenyl-1,1,2,2,3,3-hexamethyl-4-[(Z)-prop-1-enyl]thiophene

5-ethenyl-1,1,2,2,3,3-hexamethyl-4-[(Z)-prop-1-enyl]thiophene (PubChem CID 154981940) has the molecular formula C15H26S and a molecular weight of 238.44 g/mol. Its IUPAC name is 5-ethenyl-1,1,2,2,3,3-hexamethyl-4-[(Z)-prop-1-enyl]thiophene.

Molecular Properties

Compound Name5-ethenyl-1,1,2,2,3,3-hexamethyl-4-[(Z)-prop-1-enyl]thiophene
PubChem CID154981940
Molecular FormulaC15H26S
Molecular Weight238.44 g/mol
Exact Mass238.18
IUPAC Name5-ethenyl-1,1,2,2,3,3-hexamethyl-4-[(Z)-prop-1-enyl]thiophene
SMILESC=CC1=C(/C=C\C)C(C)(C)C(C)(C)S1(C)C
InChIInChI=1S/C15H26S/c1-9-11-12-13(10-2)16(7,8)15(5,6)14(12,3)4/h9-11H,2H2,1,3-8H3/b11-9-
InChIKeyXXHSGHKQQIKVEK-LUAWRHEFSA-N
XLogP4.89
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.44
LogP ≤ 54.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

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CID 59419983
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CID 70658928
CID 70658928
CID 70989773
CID 70989773
CID 87975754
CID 87975754
CID 87975760
CID 87975760
CID 87976172
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CID 87976267
CID 87976267

Frequently Asked Questions

What is the IUPAC name of 5-ethenyl-1,1,2,2,3,3-hexamethyl-4-[(Z)-prop-1-enyl]thiophene?
The IUPAC name of 5-ethenyl-1,1,2,2,3,3-hexamethyl-4-[(Z)-prop-1-enyl]thiophene (CID 154981940) is 5-ethenyl-1,1,2,2,3,3-hexamethyl-4-[(Z)-prop-1-enyl]thiophene.
What is the SMILES notation for 5-ethenyl-1,1,2,2,3,3-hexamethyl-4-[(Z)-prop-1-enyl]thiophene?
The canonical SMILES for 5-ethenyl-1,1,2,2,3,3-hexamethyl-4-[(Z)-prop-1-enyl]thiophene is C=CC1=C(/C=C\C)C(C)(C)C(C)(C)S1(C)C.
What is the InChIKey of 5-ethenyl-1,1,2,2,3,3-hexamethyl-4-[(Z)-prop-1-enyl]thiophene?
The InChIKey is XXHSGHKQQIKVEK-LUAWRHEFSA-N. The full InChI is InChI=1S/C15H26S/c1-9-11-12-13(10-2)16(7,8)15(5,6)14(12,3)4/h9-11H,2H2,1,3-8H3/b11-9-.
What are the key properties of 5-ethenyl-1,1,2,2,3,3-hexamethyl-4-[(Z)-prop-1-enyl]thiophene?
5-ethenyl-1,1,2,2,3,3-hexamethyl-4-[(Z)-prop-1-enyl]thiophene has a molecular weight of 238.44 g/mol, XLogP of 4.89, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethenyl-1,1,2,2,3,3-hexamethyl-4-[(Z)-prop-1-enyl]thiophene is sourced from PubChem (CID 154981940), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).