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Structure

Ethyl 2-chloro-2-[2-(3,5-dichlorophenyl)hydrazono]acetate

CAS
96722-61-1
Catalog Number
ACM96722611
Category
Other Products
Molecular Weight
295.55
Molecular Formula
C10H9Cl3N2O2

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Specification

Synonyms
ETHYL 2-CHLORO-2-[2-(3,5-DICHLOROPHENYL)HYDRAZONO] ACETATE;Ethyl 2-chloro-2-[2-(3,5-dichlorophenyl)hydrazono]
IUPAC Name
ethyl (2Z)-2-chloro-2-[(3,5-dichlorophenyl)hydrazinylidene]acetate
Canonical SMILES
CCOC(=O)C(=NNC1=CC(=CC(=C1)Cl)Cl)Cl
InChI Key
ZVPXWWKVQCJEGR-DHDCSXOGSA-N
Boiling Point
359.9±52.0 °C (760 mmHg)
Melting Point
125 °C(methanol)
Density
1.43±0.1 g/cm³(20 °C , 760mmHg)
Exact Mass
293.97300
H-Bond Acceptor
4
H-Bond Donor
1
What is the molecular formula of Ethyl 2-chloro-2-[2-(3,5-dichlorophenyl)hydrazono]acetate?

The molecular formula is C10H9Cl3N2O2.

What is the molecular weight of Ethyl 2-chloro-2-[2-(3,5-dichlorophenyl)hydrazono]acetate?

The molecular weight is 295.5 g/mol.

What is the IUPAC name of Ethyl 2-chloro-2-[2-(3,5-dichlorophenyl)hydrazono]acetate?

The IUPAC name is ethyl (2E)-2-chloro-2-[(3,5-dichlorophenyl)hydrazinylidene]acetate.

What is the InChI of Ethyl 2-chloro-2-[2-(3,5-dichlorophenyl)hydrazono]acetate?

The InChI is InChI=1S/C10H9Cl3N2O2/c1-2-17-10(16)9(13)15-14-8-4-6(11)3-7(12)5-8/h3-5,14H,2H2,1H3/b15-9+.

What is the Canonical SMILES of Ethyl 2-chloro-2-[2-(3,5-dichlorophenyl)hydrazono]acetate?

The Canonical SMILES is CCOC(=O)C(=NNC1=CC(=CC(=C1)Cl)Cl)Cl.

How many hydrogen bond donor counts are there in Ethyl 2-chloro-2-[2-(3,5-dichlorophenyl)hydrazono]acetate?

There is 1 hydrogen bond donor count.

What is the XLogP3 value of Ethyl 2-chloro-2-[2-(3,5-dichlorophenyl)hydrazono]acetate?

The XLogP3 value is 4.7.

How many hydrogen bond acceptor counts are there in Ethyl 2-chloro-2-[2-(3,5-dichlorophenyl)hydrazono]acetate?

There are 4 hydrogen bond acceptor counts.

What is the topological polar surface area of Ethyl 2-chloro-2-[2-(3,5-dichlorophenyl)hydrazono]acetate?

The topological polar surface area is 50.7 Å2.

Is Ethyl 2-chloro-2-[2-(3,5-dichlorophenyl)hydrazono]acetate a covalently-bonded unit?

Yes, it is a covalently-bonded unit.

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