[2,5-bis(4-phenylphenyl)-4-trimethylstannylphenyl]-trimethylstannane

C36H38Sn2 — CID 140617332

IUPAC[2,5-bis(4-phenylphenyl)-4-trimethylstannylphenyl]-trimethylstannane
SMILESC[Sn](C)(C)c1cc(-c2ccc(-c3ccccc3)cc2)c([Sn](C)(C)C)cc1-c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C30H20.6CH3.2Sn/c1-3-7-23(8-4-1)25-11-15-27(16-12-25)29-19-21-30(22-20-29)28-17-13-26(14-18-28)24-9-5-2-6-10-24;;;;;;;;/h1-19,22H;6*1H3;;
InChIKeyYIONCJWSGBCKPO-UHFFFAOYSA-N
MW708.12 g/mol
LogP9.44
Rot. Bonds6

About [2,5-bis(4-phenylphenyl)-4-trimethylstannylphenyl]-trimethylstannane

[2,5-bis(4-phenylphenyl)-4-trimethylstannylphenyl]-trimethylstannane (PubChem CID 140617332) has the molecular formula C36H38Sn2 and a molecular weight of 708.12 g/mol. Its IUPAC name is [2,5-bis(4-phenylphenyl)-4-trimethylstannylphenyl]-trimethylstannane.

Molecular Properties

Compound Name[2,5-bis(4-phenylphenyl)-4-trimethylstannylphenyl]-trimethylstannane
PubChem CID140617332
Molecular FormulaC36H38Sn2
Molecular Weight708.12 g/mol
Exact Mass710.10
IUPAC Name[2,5-bis(4-phenylphenyl)-4-trimethylstannylphenyl]-trimethylstannane
SMILESC[Sn](C)(C)c1cc(-c2ccc(-c3ccccc3)cc2)c([Sn](C)(C)C)cc1-c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C30H20.6CH3.2Sn/c1-3-7-23(8-4-1)25-11-15-27(16-12-25)29-19-21-30(22-20-29)28-17-13-26(14-18-28)24-9-5-2-6-10-24;;;;;;;;/h1-19,22H;6*1H3;;
InChIKeyYIONCJWSGBCKPO-UHFFFAOYSA-N
XLogP9.44
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms38
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500708.12
LogP ≤ 59.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

1,4-bis[4-[4-[4-(4-phenylphenyl)phenyl]phenyl]phenyl]benzene;ethane;1-phenyl-4-[4-[4-[4-[4-[4-[4-[4-[4-(4-phenylphenyl)phenyl]phenyl]phenyl]phenyl]phenyl]phenyl]phenyl]phenyl]benzene
CID 162041275
1,4-diphenylbenzene;1-phenyl-4-(4-phenylphenyl)benzene
CID 162098364
1-phenyl-3,6,8-tris(4-phenylphenyl)pyrene
CID 59391253
11-phenylnonacyclo[28.2.2.22,5.26,9.210,13.214,17.218,21.222,25.226,29]octatetraconta-1(32),2(48),3,5(47),6(46),7,9(45),10,12,14(42),15,17(41),18,20,22,24,26,28,30,33,35,37,39,43-tetracosaene
CID 135036112
2-(4-phenylphenyl)bicyclo[2.2.0]hexa-1,3,5-triene
CID 174878589
1,2,4-triphenylbenzene
CID 518325
4-[4-[2,4-diphenyl-5-(4-pyridin-4-ylphenyl)phenyl]phenyl]pyridine
CID 67990612
2,6-diphenyl-3,5-bis(4-phenylphenyl)pyridine
CID 122233247
benzene;1,1'-biphenyl;ethane
CID 158550617
benzene;tris(1,1'-biphenyl)
CID 162155747
trimethyl-(2-phenyl-5-trimethylstannyl-4-pyridinyl)stannane
CID 14690003
5,8-bis(4-phenylphenyl)benzo[c]phenanthrene
CID 58526355

Frequently Asked Questions

What is the IUPAC name of [2,5-bis(4-phenylphenyl)-4-trimethylstannylphenyl]-trimethylstannane?
The IUPAC name of [2,5-bis(4-phenylphenyl)-4-trimethylstannylphenyl]-trimethylstannane (CID 140617332) is [2,5-bis(4-phenylphenyl)-4-trimethylstannylphenyl]-trimethylstannane.
What is the SMILES notation for [2,5-bis(4-phenylphenyl)-4-trimethylstannylphenyl]-trimethylstannane?
The canonical SMILES for [2,5-bis(4-phenylphenyl)-4-trimethylstannylphenyl]-trimethylstannane is C[Sn](C)(C)c1cc(-c2ccc(-c3ccccc3)cc2)c([Sn](C)(C)C)cc1-c1ccc(-c2ccccc2)cc1.
What is the InChIKey of [2,5-bis(4-phenylphenyl)-4-trimethylstannylphenyl]-trimethylstannane?
The InChIKey is YIONCJWSGBCKPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H20.6CH3.2Sn/c1-3-7-23(8-4-1)25-11-15-27(16-12-25)29-19-21-30(22-20-29)28-17-13-26(14-18-28)24-9-5-2-6-10-24;;;;;;;;/h1-19,22H;6*1H3;;.
What are the key properties of [2,5-bis(4-phenylphenyl)-4-trimethylstannylphenyl]-trimethylstannane?
[2,5-bis(4-phenylphenyl)-4-trimethylstannylphenyl]-trimethylstannane has a molecular weight of 708.12 g/mol, XLogP of 9.44, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for [2,5-bis(4-phenylphenyl)-4-trimethylstannylphenyl]-trimethylstannane is sourced from PubChem (CID 140617332), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).