[(E)-1-methylsulfanylhept-1-enyl]tellanylbenzene

C14H20STe — CID 11046275

IUPAC[(E)-1-methylsulfanylhept-1-enyl]tellanylbenzene
SMILESCCCCC/C=C(\SC)[Te]c1ccccc1
InChIInChI=1S/C14H20STe/c1-3-4-5-9-12-14(15-2)16-13-10-7-6-8-11-13/h6-8,10-12H,3-5,9H2,1-2H3/b14-12+
InChIKeyVGACHFITSZEBQV-WYMLVPIESA-N
MW347.98 g/mol
LogP3.80
Rot. Bonds7

About [(E)-1-methylsulfanylhept-1-enyl]tellanylbenzene

[(E)-1-methylsulfanylhept-1-enyl]tellanylbenzene (PubChem CID 11046275) has the molecular formula C14H20STe and a molecular weight of 347.98 g/mol. Its IUPAC name is [(E)-1-methylsulfanylhept-1-enyl]tellanylbenzene.

Molecular Properties

Compound Name[(E)-1-methylsulfanylhept-1-enyl]tellanylbenzene
PubChem CID11046275
Molecular FormulaC14H20STe
Molecular Weight347.98 g/mol
Exact Mass350.03
IUPAC Name[(E)-1-methylsulfanylhept-1-enyl]tellanylbenzene
SMILESCCCCC/C=C(\SC)[Te]c1ccccc1
InChIInChI=1S/C14H20STe/c1-3-4-5-9-12-14(15-2)16-13-10-7-6-8-11-13/h6-8,10-12H,3-5,9H2,1-2H3/b14-12+
InChIKeyVGACHFITSZEBQV-WYMLVPIESA-N
XLogP3.80
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.98
LogP ≤ 53.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

[(E)-tetradec-3-en-4-yl]tellanylbenzene
CID 134933054
[(Z)-1-phenylhept-1-enyl]sulfanylbenzene
CID 10924031
[(Z)-1-phenylsulfanylundec-1-enyl]benzene
CID 134932780
[(E)-1-iodohept-1-en-2-yl]tellanylbenzene
CID 10693787
1-chlorooct-1-enylsulfanylbenzene
CID 73098028
[(Z)-2-butyltellanyl-2-methylsulfanylethenyl]benzene
CID 134987860
sodium;hydride;1-phenyltetradec-1-enylbenzene
CID 173018182
[(Z)-nonadec-9-en-9-yl]sulfanylbenzene
CID 100973714
[(E)-tridec-6-en-6-yl]sulfanylbenzene
CID 102371655
[(E)-1-deuteriooct-1-enyl]tellanylbenzene
CID 134992596
2-phenylundec-2-ene-1-thiol
CID 175069404
[(E)-non-3-en-3-yl]selanylbenzene
CID 102123205

Frequently Asked Questions

What is the IUPAC name of [(E)-1-methylsulfanylhept-1-enyl]tellanylbenzene?
The IUPAC name of [(E)-1-methylsulfanylhept-1-enyl]tellanylbenzene (CID 11046275) is [(E)-1-methylsulfanylhept-1-enyl]tellanylbenzene.
What is the SMILES notation for [(E)-1-methylsulfanylhept-1-enyl]tellanylbenzene?
The canonical SMILES for [(E)-1-methylsulfanylhept-1-enyl]tellanylbenzene is CCCCC/C=C(\SC)[Te]c1ccccc1.
What is the InChIKey of [(E)-1-methylsulfanylhept-1-enyl]tellanylbenzene?
The InChIKey is VGACHFITSZEBQV-WYMLVPIESA-N. The full InChI is InChI=1S/C14H20STe/c1-3-4-5-9-12-14(15-2)16-13-10-7-6-8-11-13/h6-8,10-12H,3-5,9H2,1-2H3/b14-12+.
What are the key properties of [(E)-1-methylsulfanylhept-1-enyl]tellanylbenzene?
[(E)-1-methylsulfanylhept-1-enyl]tellanylbenzene has a molecular weight of 347.98 g/mol, XLogP of 3.80, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [(E)-1-methylsulfanylhept-1-enyl]tellanylbenzene is sourced from PubChem (CID 11046275), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).