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Structure

N-(2-Hydroxynaphthoyl)-2,4-dimethoxy-5-chloroanilide

CAS
92-72-8
Catalog Number
ACM92728
Category
Azoic Dyes
Molecular Weight
357.79
Molecular Formula
C19H16ClNO4

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Specification

Synonyms
2-Naphthanilide, 5'-chloro-3-hydroxy-2',4'-dimethoxy-;Acco Naf-Sol AS-ITR;Acco Naphthol AS-ITR;Acna Naphthol SS;Amanil Naphthol AS-ITR;Azoground ITR;Azotol O;C.I. 37550
IUPAC Name
N-(5-chloro-2,4-dimethoxyphenyl)-3-hydroxynaphthalene-2-carboxamide
Canonical SMILES
COC1=CC(=C(C=C1NC(=O)C2=CC3=CC=CC=C3C=C2O)Cl)OC
InChI Key
XDWATWCCUTYUDE-UHFFFAOYSA-N
Boiling Point
480.3ºC at 760 mmHg
Melting Point
200ºC
Flash Point
244.3ºC
Density
1.371 g/cm³
Appearance
Light grey homogeneous powder
EC Number
202-182-9
Exact Mass
357.07700
Hazard Statements
Xi
H-Bond Acceptor
4
H-Bond Donor
2
Safety Description
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36:Wear suitable protective clothing .
WGK Germany
3
What is the molecular formula of N-(2-Hydroxynaphthoyl)-2,4-dimethoxy-5-chloroanilide?

The molecular formula is C19H16ClNO4.

What is the molecular weight of N-(2-Hydroxynaphthoyl)-2,4-dimethoxy-5-chloroanilide?

The molecular weight is 357.8 g/mol.

What are some synonyms of N-(2-Hydroxynaphthoyl)-2,4-dimethoxy-5-chloroanilide?

Some synonyms include Naphthol AS-ITR, 5'-Chloro-3-hydroxy-2',4'-dimethoxy-2-naphthanilide, and Azotol O.

What is the IUPAC name of N-(2-Hydroxynaphthoyl)-2,4-dimethoxy-5-chloroanilide?

The IUPAC name is N-(5-chloro-2,4-dimethoxyphenyl)-3-hydroxynaphthalene-2-carboxamide.

What is the InChI of N-(2-Hydroxynaphthoyl)-2,4-dimethoxy-5-chloroanilide?

The InChI is InChI=1S/C19H16ClNO4/c1-24-17-10-18(25-2)15(9-14(17)20)21-19(23)13-7-11-5-3-4-6-12(11)8-16(13)22/h3-10,22H,1-2H3,(H,21,23).

What is the InChIKey of N-(2-Hydroxynaphthoyl)-2,4-dimethoxy-5-chloroanilide?

The InChIKey is XDWATWCCUTYUDE-UHFFFAOYSA-N.

How many hydrogen bond donor counts does N-(2-Hydroxynaphthoyl)-2,4-dimethoxy-5-chloroanilide have?

It has 2 hydrogen bond donor counts.

What is the XLogP3-AA value of N-(2-Hydroxynaphthoyl)-2,4-dimethoxy-5-chloroanilide?

The XLogP3-AA value is 4.8.

How many hydrogen bond acceptor counts does N-(2-Hydroxynaphthoyl)-2,4-dimethoxy-5-chloroanilide have?

It has 4 hydrogen bond acceptor counts.

What is the topological polar surface area of N-(2-Hydroxynaphthoyl)-2,4-dimethoxy-5-chloroanilide?

The topological polar surface area is 67.8 Å2.

What are some synonyms for N-(2-Hydroxynaphthoyl)-2,4-dimethoxy-5-chloroanilide?

Some synonyms include 92-72-8, Naphthol AS-ITR, 5'-Chloro-3-hydroxy-2',4'-dimethoxy-2-naphthanilide, Azotol O, and N-(5-Chloro-2,4-dimethoxyphenyl)-3-hydroxy-2-naphthamide.

What is the Canonical SMILES representation of N-(2-Hydroxynaphthoyl)-2,4-dimethoxy-5-chloroanilide?

COC1=CC(=C(C=C1NC(=O)C2=CC3=CC=CC=C3C=C2O)Cl)OC

What is the CAS number for N-(2-Hydroxynaphthoyl)-2,4-dimethoxy-5-chloroanilide?

The CAS number is 92-72-8.

How many rotatable bond counts does N-(2-Hydroxynaphthoyl)-2,4-dimethoxy-5-chloroanilide have?

It has 4 rotatable bond counts.

What is the complexity value of N-(2-Hydroxynaphthoyl)-2,4-dimethoxy-5-chloroanilide?

The complexity value is 463.

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