CAS
99-71-8 Purity
98%
99-71-8 Purity
98%
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O-(B-Chloroethoxy)Benzenesulfonylisocyanate
CAS
99722-82-4
Catalog Number
ACM99722824
Category
Other Products
Molecular Weight
261.682120 [g/mol]
Molecular Formula
C9H8ClNO4S
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Specification
Synonyms
CTK3I5770, S846, Benzenesulfonylisocyanate, 2-(2-chloroethoxy)-, o-(beta-chloro ethoxy)benzene sulfonyl isocyanate, 99722-82-4
IUPAC Name
2-(2-chloroethoxy)-N-(oxomethylidene)benzenesulfonamide
InChI Key
LGUQMNDJBRYRRA-UHFFFAOYSA-N
Exact Mass
260.98600
H-Bond Acceptor
5
H-Bond Donor
0
What is the molecular formula of O-(B-Chloroethoxy)Benzenesulfonylisocyanate?
The molecular formula is C9H8ClNO4S.
When was O-(B-Chloroethoxy)Benzenesulfonylisocyanate first created in the PubChem database?
It was first created on December 4, 2007.
What is the InChIKey for O-(B-Chloroethoxy)Benzenesulfonylisocyanate?
The InChIKey is LGUQMNDJBRYRRA-UHFFFAOYSA-N.
How many hydrogen bond acceptor counts are there in the O-(B-Chloroethoxy)Benzenesulfonylisocyanate molecule?
There are 5 hydrogen bond acceptor counts.
What is the XLogP3-AA value for O-(B-Chloroethoxy)Benzenesulfonylisocyanate?
The XLogP3-AA value is 2.9.
Is the compound canonicalized according to PubChem?
Yes, the compound is canonicalized.
What is the topological polar surface area of O-(B-Chloroethoxy)Benzenesulfonylisocyanate?
The topological polar surface area is 81.2 Ų.
How many rotatable bond counts are there in the O-(B-Chloroethoxy)Benzenesulfonylisocyanate molecule?
There are 5 rotatable bond counts.
What is the exact mass of O-(B-Chloroethoxy)Benzenesulfonylisocyanate?
The exact mass is 260.9862566 g/mol.
What is the complexity value of O-(B-Chloroethoxy)Benzenesulfonylisocyanate?
The complexity value is 358.
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