CAS
925233-21-2 Purity
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925233-21-2 Purity
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3-Pyrrolidinecarboxylicacid,1-(2-chloro-3-hydroxyphenyl)-
CAS
925233-24-5
Catalog Number
ACM925233245
Category
Other Products
Molecular Formula
C11H12ClNO3
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What is the molecular formula of the compound?
The molecular formula is C11H12ClNO3.
What are the synonyms for the compound?
The synonyms include 925233-24-5, 1-(2-Chloro-3-hydroxyphenyl)pyrrolidine-3-carboxylic acid, 3-Pyrrolidinemethanol,1-(2-chloro-3-hydroxyphenyl)-, SCHEMBL2939905, and DTXSID50738366.
What is the molecular weight of the compound?
The molecular weight is 241.67 g/mol.
What is the IUPAC name of the compound?
The IUPAC name is 1-(2-chloro-3-hydroxyphenyl)pyrrolidine-3-carboxylic acid.
What is the InChI of the compound?
The InChI is InChI=1S/C11H12ClNO3/c12-10-8(2-1-3-9(10)14)13-5-4-7(6-13)11(15)16/h1-3,7,14H,4-6H2,(H,15,16).
What is the InChIKey of the compound?
The InChIKey is KYOZXWAIGCLKSO-UHFFFAOYSA-N.
What is the canonical SMILES of the compound?
The canonical SMILES is C1CN(CC1C(=O)O)C2=C(C(=CC=C2)O)Cl.
What is the XLogP3-AA value of the compound?
The XLogP3-AA value is 2.
How many hydrogen bond donor count does the compound have?
The compound has 2 hydrogen bond donor count.
How many hydrogen bond acceptor count does the compound have?
The compound has 4 hydrogen bond acceptor count.
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