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Structure

2-Thiophenesulfonylchloride,5-phenyl-

CAS
97272-02-1
Catalog Number
ACM97272021
Category
Other Products
Molecular Weight
258.74
Molecular Formula
C10H7ClO2S2

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Specification

Synonyms
5-PHENYLTHIOPHENE-2-SULPHONYL CHLORIDE;5-PHENYL-2-THIOPHENESULFONYL CHLORIDE;5-Phenylthiophene-2-sulphonyl chloride 95%
IUPAC Name
5-phenylthiophene-2-sulfonyl chloride
Canonical SMILES
C1=CC=C(C=C1)C2=CC=C(S2)S(=O)(=O)Cl
InChI Key
NHRKTBLHJKMFTP-UHFFFAOYSA-N
Boiling Point
397.4ºC at 760mmHg
Melting Point
85-87ºC
Flash Point
194.1ºC
Density
1.43g/cm³
Exact Mass
257.95800
Hazard Statements
C: Corrosive;
H-Bond Acceptor
3
H-Bond Donor
0
What is the molecular formula of 2-Thiophenesulfonylchloride, 5-phenyl?

The molecular formula is C10H7ClO2S2.

When was the compound created and last modified in PubChem?

It was created on 2007-02-08 and last modified on 2023-12-30.

What is the IUPAC name of the compound?

The IUPAC name is 5-phenylthiophene-2-sulfonyl chloride.

What is the InChIKey of the compound?

The InChIKey is NHRKTBLHJKMFTP-UHFFFAOYSA-N.

How many hydrogen bond acceptor counts does the compound have?

It has 3 hydrogen bond acceptor counts.

What is the exact mass of the compound?

The exact mass is 257.9575995 g/mol.

What is the topological polar surface area of the compound?

The topological polar surface area is 70.8 Ų.

How many rotatable bond counts does the compound have?

It has 2 rotatable bond counts.

Is the compound canonicalized?

Yes, the compound is canonicalized.

What is the molecular weight of the compound?

The molecular weight is 258.7 g/mol.

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