CAS
96-72-0 Purity
96%
96-72-0 Purity
96%
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Acetic acid,2-chloro-2-[2-(3-methoxyphenyl)hydrazinylidene]-,methyl ester
CAS
96722-47-3
Catalog Number
ACM96722473
Category
Other Products
Molecular Weight
242.6589
Molecular Formula
C10H11ClN2O3
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Specification
Synonyms
METHYL CHLORO[(3-METHOXYLPHENYL)HYDRAZONO]ACETATE
IUPAC Name
methyl (2Z)-2-chloro-2-[(3-methoxyphenyl)hydrazinylidene]acetate
Canonical SMILES
COC1=CC=CC(=C1)NN=C(C(=O)OC)Cl
InChI Key
ZLHIFGKYLOUABG-LCYFTJDESA-N
Boiling Point
330.9ºC at 760 mmHg
Flash Point
153.9ºC
Density
1.26 g/cm³
Exact Mass
242.04600
H-Bond Acceptor
5
H-Bond Donor
1
What is the molecular formula of the compound?
The molecular formula of the compound is C10H11ClN2O3.
What are the synonyms of the compound?
The synonyms of the compound are Acetic acid, 2-chloro-2-[2-(3-methoxyphenyl)hydrazinylidene]-, methyl ester.
What is the molecular weight of the compound?
The molecular weight of the compound is 242.66 g/mol.
When was the compound created?
The compound was created on August 9, 2005.
When was the compound last modified?
The compound was last modified on December 30, 2023.
What is the IUPAC name of the compound?
The IUPAC name of the compound is methyl (2E)-2-chloro-2-[(3-methoxyphenyl)hydrazinylidene]acetate.
What is the InChI of the compound?
The InChI of the compound is InChI=1S/C10H11ClN2O3/c1-15-8-5-3-4-7(6-8)12-13-9(11)10(14)16-2/h3-6,12H,1-2H3/b13-9+.
What is the InChIKey of the compound?
The InChIKey of the compound is ZLHIFGKYLOUABG-UKTHLTGXSA-N.
What is the canonical SMILES of the compound?
The canonical SMILES of the compound is COC1=CC=CC(=C1)NN=C(C(=O)OC)Cl.
What is the XLogP3-AA value of the compound?
The XLogP3-AA value of the compound is 3.7.
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