CAS
90224-62-7 Purity
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90224-62-7 Purity
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2-Chlorobenzothiazole-5-carboxylic acid methyl ester
CAS
90225-03-9
Catalog Number
ACM90225039
Category
Other Products
Molecular Weight
227.667440 [g/mol]
Molecular Formula
C9H6ClNO2S
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Specification
Synonyms
SureCN1121389, AB66366, METHYL 2-CHLOROBENZO[D]THIAZOLE-5-CARBOXYLATE, METHYL 2-CHLORO-1,3-BENZOTHIAZOLE-5-CARBOXYLATE, 2-CHLORO-BENZOTHIAZOLE-5-CARBOXYLIC ACID METHYL ESTER, 90225-03-9
IUPAC Name
methyl 2-chloro-1,3-benzothiazole-5-carboxylate
InChI Key
BYLOHEPCHOXXGW-UHFFFAOYSA-N
Exact Mass
226.98100
H-Bond Acceptor
4
H-Bond Donor
0
What is the molecular formula of 2-Chlorobenzothiazole-5-carboxylic acid methyl ester?
The molecular formula is C9H6ClNO2S.
What are some synonyms for 2-Chlorobenzothiazole-5-carboxylic acid methyl ester?
Some synonyms include METHYL 2-CHLOROBENZO[D]THIAZOLE-5-CARBOXYLATE and METHYL 2-CHLORO-1,3-BENZOTHIAZOLE-5-CARBOXYLATE.
What is the molecular weight of 2-Chlorobenzothiazole-5-carboxylic acid methyl ester?
The molecular weight is 227.67 g/mol.
What is the IUPAC name of 2-Chlorobenzothiazole-5-carboxylic acid methyl ester?
The IUPAC name is methyl 2-chloro-1,3-benzothiazole-5-carboxylate.
What is the InChI of 2-Chlorobenzothiazole-5-carboxylic acid methyl ester?
The InChI is InChI=1S/C9H6ClNO2S/c1-13-8(12)5-2-3-7-6(4-5)11-9(10)14-7/h2-4H,1H3.
How many hydrogen bond donor counts are there in 2-Chlorobenzothiazole-5-carboxylic acid methyl ester?
There are 0 hydrogen bond donor counts.
What is the XLogP3-AA value of 2-Chlorobenzothiazole-5-carboxylic acid methyl ester?
The XLogP3-AA value is 3.2.
What is the topological polar surface area of 2-Chlorobenzothiazole-5-carboxylic acid methyl ester?
The topological polar surface area is 67.4 Ų.
How many rotatable bond counts are there in 2-Chlorobenzothiazole-5-carboxylic acid methyl ester?
There are 2 rotatable bond counts.
Is 2-Chlorobenzothiazole-5-carboxylic acid methyl ester a canonicalized compound?
Yes, it is a canonicalized compound.
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