trimethyl-[5-[5-(5-trimethylstannylthiophen-2-yl)thiophen-2-yl]thiophen-2-yl]stannane

C18H24S3Sn2 — CID 71353375

IUPACtrimethyl-[5-[5-(5-trimethylstannylthiophen-2-yl)thiophen-2-yl]thiophen-2-yl]stannane
SMILESC[Sn](C)(C)c1ccc(-c2ccc(-c3ccc([Sn](C)(C)C)s3)s2)s1
InChIInChI=1S/C12H6S3.6CH3.2Sn/c1-3-9(13-7-1)11-5-6-12(15-11)10-4-2-8-14-10;;;;;;;;/h1-6H;6*1H3;;
InChIKeyFIKQPMKITUNTEK-UHFFFAOYSA-N
MW574.01 g/mol
LogP6.30
Rot. Bonds4

About trimethyl-[5-[5-(5-trimethylstannylthiophen-2-yl)thiophen-2-yl]thiophen-2-yl]stannane

trimethyl-[5-[5-(5-trimethylstannylthiophen-2-yl)thiophen-2-yl]thiophen-2-yl]stannane (PubChem CID 71353375) has the molecular formula C18H24S3Sn2 and a molecular weight of 574.01 g/mol. Its IUPAC name is trimethyl-[5-[5-(5-trimethylstannylthiophen-2-yl)thiophen-2-yl]thiophen-2-yl]stannane.

Molecular Properties

Compound Nametrimethyl-[5-[5-(5-trimethylstannylthiophen-2-yl)thiophen-2-yl]thiophen-2-yl]stannane
PubChem CID71353375
Molecular FormulaC18H24S3Sn2
Molecular Weight574.01 g/mol
Exact Mass575.91
IUPAC Nametrimethyl-[5-[5-(5-trimethylstannylthiophen-2-yl)thiophen-2-yl]thiophen-2-yl]stannane
SMILESC[Sn](C)(C)c1ccc(-c2ccc(-c3ccc([Sn](C)(C)C)s3)s2)s1
InChIInChI=1S/C12H6S3.6CH3.2Sn/c1-3-9(13-7-1)11-5-6-12(15-11)10-4-2-8-14-10;;;;;;;;/h1-6H;6*1H3;;
InChIKeyFIKQPMKITUNTEK-UHFFFAOYSA-N
XLogP6.30
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500574.01
LogP ≤ 56.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2,2':5',2''-Terthiophene
CID 65067
2,2':5',2'',5'',2'''-Quaterthiophene
CID 395493
2,2':5',2''-Terthiophene, 5-methyl-
CID 176446
2,5-Bis[5-(4-bromobutyl)thiophen-2-yl]thiophene
CID 137653771
2,2'-Bithiophene, 5-(3-buten-1-ynyl)-5'-methyl-
CID 3083681
5,5'-Bis(trimethylstannyl)-2,2'-bithiophene
CID 635441
5-Hexyl-2,2'-bithiophene
CID 15363594
2,5-Bis[5-(3-bromopropyl)thiophen-2-yl]thiophene
CID 137638045
2,2':5',2''-Terthiophene, 5-iodo-
CID 184312
2,2'-Dithienylmethane
CID 138192
2,5-Bis(2-thienylethynyl)thiophene
CID 179713
2-Methyl-5-(thiophen-2-YL)thiophene
CID 11041328

Frequently Asked Questions

What is the IUPAC name of trimethyl-[5-[5-(5-trimethylstannylthiophen-2-yl)thiophen-2-yl]thiophen-2-yl]stannane?
The IUPAC name of trimethyl-[5-[5-(5-trimethylstannylthiophen-2-yl)thiophen-2-yl]thiophen-2-yl]stannane (CID 71353375) is trimethyl-[5-[5-(5-trimethylstannylthiophen-2-yl)thiophen-2-yl]thiophen-2-yl]stannane.
What is the SMILES notation for trimethyl-[5-[5-(5-trimethylstannylthiophen-2-yl)thiophen-2-yl]thiophen-2-yl]stannane?
The canonical SMILES for trimethyl-[5-[5-(5-trimethylstannylthiophen-2-yl)thiophen-2-yl]thiophen-2-yl]stannane is C[Sn](C)(C)c1ccc(-c2ccc(-c3ccc([Sn](C)(C)C)s3)s2)s1.
What is the InChIKey of trimethyl-[5-[5-(5-trimethylstannylthiophen-2-yl)thiophen-2-yl]thiophen-2-yl]stannane?
The InChIKey is FIKQPMKITUNTEK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H6S3.6CH3.2Sn/c1-3-9(13-7-1)11-5-6-12(15-11)10-4-2-8-14-10;;;;;;;;/h1-6H;6*1H3;;.
What are the key properties of trimethyl-[5-[5-(5-trimethylstannylthiophen-2-yl)thiophen-2-yl]thiophen-2-yl]stannane?
trimethyl-[5-[5-(5-trimethylstannylthiophen-2-yl)thiophen-2-yl]thiophen-2-yl]stannane has a molecular weight of 574.01 g/mol, XLogP of 6.30, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[5-[5-(5-trimethylstannylthiophen-2-yl)thiophen-2-yl]thiophen-2-yl]stannane is sourced from PubChem (CID 71353375), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).