2,3,4,5-tetramethyl-1-phenylbismole

C14H17Bi — CID 14026311

IUPAC2,3,4,5-tetramethyl-1-phenylbismole
SMILESCC1=C(C)[Bi](c2ccccc2)C(C)=C1C
InChIInChI=1S/C8H12.C6H5.Bi/c1-5-7(3)8(4)6-2;1-2-4-6-5-3-1;/h1-4H3;1-5H;
InChIKeyUBHSRANUPVFKKO-UHFFFAOYSA-N
MW394.27 g/mol
LogP3.15
Rot. Bonds1

About 2,3,4,5-tetramethyl-1-phenylbismole

2,3,4,5-tetramethyl-1-phenylbismole (PubChem CID 14026311) has the molecular formula C14H17Bi and a molecular weight of 394.27 g/mol. Its IUPAC name is 2,3,4,5-tetramethyl-1-phenylbismole.

Molecular Properties

Compound Name2,3,4,5-tetramethyl-1-phenylbismole
PubChem CID14026311
Molecular FormulaC14H17Bi
Molecular Weight394.27 g/mol
Exact Mass394.11
IUPAC Name2,3,4,5-tetramethyl-1-phenylbismole
SMILESCC1=C(C)[Bi](c2ccccc2)C(C)=C1C
InChIInChI=1S/C8H12.C6H5.Bi/c1-5-7(3)8(4)6-2;1-2-4-6-5-3-1;/h1-4H3;1-5H;
InChIKeyUBHSRANUPVFKKO-UHFFFAOYSA-N
XLogP3.15
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500394.27
LogP ≤ 53.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 2,3,4,5-tetramethyl-1-phenylbismole?
The IUPAC name of 2,3,4,5-tetramethyl-1-phenylbismole (CID 14026311) is 2,3,4,5-tetramethyl-1-phenylbismole.
What is the SMILES notation for 2,3,4,5-tetramethyl-1-phenylbismole?
The canonical SMILES for 2,3,4,5-tetramethyl-1-phenylbismole is CC1=C(C)[Bi](c2ccccc2)C(C)=C1C.
What is the InChIKey of 2,3,4,5-tetramethyl-1-phenylbismole?
The InChIKey is UBHSRANUPVFKKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12.C6H5.Bi/c1-5-7(3)8(4)6-2;1-2-4-6-5-3-1;/h1-4H3;1-5H;.
What are the key properties of 2,3,4,5-tetramethyl-1-phenylbismole?
2,3,4,5-tetramethyl-1-phenylbismole has a molecular weight of 394.27 g/mol, XLogP of 3.15, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3,4,5-tetramethyl-1-phenylbismole is sourced from PubChem (CID 14026311), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).