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Tris(4-methylphenyl)bismuthine

HCID 340259
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Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
5142-75-6
Standard SMILES
Cc1cc[c]([Bi]([c]2ccc(C)cc2)[c]2ccc(C)cc2)cc1
InChIKey
XIECNHSGPKDTNW-UHFFFAOYSA-N
Molecular formula
C21H21Bi
Average molar mass
482.4 g/mol
Monoisotopic mass
482.14472

Names & identifiers

Preferred name
Tris(4-methylphenyl)bismuthine
IUPAC
tris(4-methylphenyl)bismuthane
English name
TRI-P-TOLYLBISMUTHINE
Molecular formula
C21H21Bi
Molecular weight
482.37

Names & synonyms

Tri-p-tolylbismuthine5142-75-6Tris(4-methylphenyl)bismuthinetris(4-methylphenyl)bismuthaneBismuthine, tris(4-methylphenyl)-tri-p-tolylbismuthNSC370497tris(4-methylphenyl)bimuthineSCHEMBL912724DTXSID20321123XIECNHSGPKDTNW-UHFFFAOYSA-NSTK368373
Show more names
Tri(p-tolyl)bismuthTRIS(4-TOLYL)BISMUTHTRIS(P-TOLYL)BISMUTHINETris(4-methylphenyl) bismuthBismuthine,tris[4-methylphenyl]-Tris(4-methylphenyl)bismuthine Tris(p-tolyl)bismuthine
AKOS005444348NSC-370497DB-246439ST50895512

Database identifiers

CAS
5142-75-6
PubChem CID
340259
DTXSID
DTXSID20321123
Nikkaji
J677.243I

Properties

Computed structural properties

Topological polar surface area
0 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
0
Rotatable bonds
3
Heavy atoms
22
Formal charge
0
Complexity
262

Physicochemical properties

Melting point
119 °C · 119 °C
solubility
almost transparency in THF
form
powder to crystal
color
White to Almost white
HS Code
2931.9 · 2931.90.6000

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

Safety data

hs_code
2931.90.6000

Chemistry & industry

Upstream & downstream products

Downstream products

CHEMBRDG-BB 6609577(4'-Methylbiphenyl-3-yl)-methanol

Related reactions

1 records
New reaction record
HRID 672572 reaction equation
HRID 672572As reactantTraining data from https://doi.org/10.1039/C8SC04228D (3/10)

Compound notes

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