CAS
916792-10-4 Purity
96%
916792-10-4 Purity
96%
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2-Acetoxy-4-amino-5-chlorobenzoic acid
CAS
916792-38-6
Catalog Number
ACM916792386
Category
Other Products
Molecular Weight
229.617120 [g/mol]
Molecular Formula
C9H8ClNO4
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Specification
Synonyms
2-ACETOXY-4-AMINO-5-CHLOROBENZOIC ACID, CTK6A1936, AG-C-21243, KB-166827, 916792-38-6
IUPAC Name
2-acetyloxy-4-amino-5-chlorobenzoic acid
InChI Key
XKVPFYNXMPITFU-UHFFFAOYSA-N
Exact Mass
229.01400
H-Bond Acceptor
5
H-Bond Donor
2
What is the molecular formula of 2-Acetoxy-4-amino-5-chlorobenzoic acid?
The molecular formula of 2-Acetoxy-4-amino-5-chlorobenzoic acid is C9H8ClNO4.
When was the compound created and modified?
The compound was created on 2009-05-29 and modified on 2023-12-30.
What is the IUPAC name of the compound?
The IUPAC name of the compound is 2-acetyloxy-4-amino-5-chlorobenzoic acid.
What is the molecular weight of 2-Acetoxy-4-amino-5-chlorobenzoic acid?
The molecular weight of 2-Acetoxy-4-amino-5-chlorobenzoic acid is 229.62 g/mol.
What is the InChIKey of the compound?
The InChIKey of the compound is XKVPFYNXMPITFU-UHFFFAOYSA-N.
How many hydrogen bond donor counts does the compound have?
The compound has 2 hydrogen bond donor counts.
What is the topological polar surface area of the compound?
The topological polar surface area of the compound is 89.6 Å2.
Is the compound canonicalized?
Yes, the compound is canonicalized.
What is the XLogP3-AA value of the compound?
The XLogP3-AA value of the compound is 1.1.
What is the heavy atom count of 2-Acetoxy-4-amino-5-chlorobenzoic acid?
The heavy atom count of 2-Acetoxy-4-amino-5-chlorobenzoic acid is 15.
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