5-(2-thiophen-2-ylpropan-2-yl)thiophene-2-sulfonyl chloride

C11H11ClO2S3 — CID 13425720

IUPAC5-(2-thiophen-2-ylpropan-2-yl)thiophene-2-sulfonyl chloride
SMILESCC(C)(c1cccs1)c1ccc(S(=O)(=O)Cl)s1
InChIInChI=1S/C11H11ClO2S3/c1-11(2,8-4-3-7-15-8)9-5-6-10(16-9)17(12,13)14/h3-7H,1-2H3
InChIKeyIEQRXAGJYNRDOM-UHFFFAOYSA-N
MW306.86 g/mol
LogP4.06
Rot. Bonds3

About 5-(2-thiophen-2-ylpropan-2-yl)thiophene-2-sulfonyl chloride

5-(2-thiophen-2-ylpropan-2-yl)thiophene-2-sulfonyl chloride (PubChem CID 13425720) has the molecular formula C11H11ClO2S3 and a molecular weight of 306.86 g/mol. Its IUPAC name is 5-(2-thiophen-2-ylpropan-2-yl)thiophene-2-sulfonyl chloride.

Molecular Properties

Compound Name5-(2-thiophen-2-ylpropan-2-yl)thiophene-2-sulfonyl chloride
PubChem CID13425720
Molecular FormulaC11H11ClO2S3
Molecular Weight306.86 g/mol
Exact Mass305.96
IUPAC Name5-(2-thiophen-2-ylpropan-2-yl)thiophene-2-sulfonyl chloride
SMILESCC(C)(c1cccs1)c1ccc(S(=O)(=O)Cl)s1
InChIInChI=1S/C11H11ClO2S3/c1-11(2,8-4-3-7-15-8)9-5-6-10(16-9)17(12,13)14/h3-7H,1-2H3
InChIKeyIEQRXAGJYNRDOM-UHFFFAOYSA-N
XLogP4.06
TPSA34.14 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.86
LogP ≤ 54.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

ethane;thiophene-2-sulfonyl chloride
CID 91564390
5-methyl-N-(2-thiophen-2-ylpropan-2-yl)thiophene-2-sulfonamide
CID 110870567
2-(1,1-dichloroethyl)thiophene
CID 12555703
2-(2-bromopropan-2-yl)thiophene
CID 174915633
2-tert-butylthiophene;methanamine
CID 143976463
2-tert-butylthiophene;oxaldehyde
CID 175171370
2-(1-chloro-2-methylpropan-2-yl)thiophene
CID 154107468
5-(methylsulfamoyl)thiophene-2-sulfonyl chloride
CID 163241520
2-(2,3,3,4-tetramethylpentan-2-yl)thiophene
CID 126728897
1-hydroxy-1,1-dithiophen-2-ylpropan-2-one
CID 23553455
(2S)-2-amino-2-thiophen-2-ylpropanal
CID 57139639
2-(6-methyltridecan-6-yl)thiophene
CID 139342178

Frequently Asked Questions

What is the IUPAC name of 5-(2-thiophen-2-ylpropan-2-yl)thiophene-2-sulfonyl chloride?
The IUPAC name of 5-(2-thiophen-2-ylpropan-2-yl)thiophene-2-sulfonyl chloride (CID 13425720) is 5-(2-thiophen-2-ylpropan-2-yl)thiophene-2-sulfonyl chloride.
What is the SMILES notation for 5-(2-thiophen-2-ylpropan-2-yl)thiophene-2-sulfonyl chloride?
The canonical SMILES for 5-(2-thiophen-2-ylpropan-2-yl)thiophene-2-sulfonyl chloride is CC(C)(c1cccs1)c1ccc(S(=O)(=O)Cl)s1.
What is the InChIKey of 5-(2-thiophen-2-ylpropan-2-yl)thiophene-2-sulfonyl chloride?
The InChIKey is IEQRXAGJYNRDOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11ClO2S3/c1-11(2,8-4-3-7-15-8)9-5-6-10(16-9)17(12,13)14/h3-7H,1-2H3.
What are the key properties of 5-(2-thiophen-2-ylpropan-2-yl)thiophene-2-sulfonyl chloride?
5-(2-thiophen-2-ylpropan-2-yl)thiophene-2-sulfonyl chloride has a molecular weight of 306.86 g/mol, XLogP of 4.06, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-thiophen-2-ylpropan-2-yl)thiophene-2-sulfonyl chloride is sourced from PubChem (CID 13425720), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).