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Structure

(4-Acetyloxy-7-chloro-2,3-dimethoxynaphthalen-1-yl)acetate

CAS
91431-42-4
Catalog Number
ACM91431424
Category
Other Products
Molecular Weight
338.74 g/mol
Molecular Formula
C16H15ClO6

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Specification

Synonyms
6-chloro-1,4-diacetoxy-2,3-dimethoxynaphthalene; LONAPALENE; Lonapaleno; Lonapalenum; 6-chloro-2,3-dimethoxy-1,4-naphthalenediol; 1,4-diacetoxy-6-chloro-2,3-dimethoxynaphthalene; 6-chloro-1,4-diacetyloxy-2,3-dimethoxynaphthalene;
IUPAC Name
(4-acetyloxy-6-chloro-2,3-dimethoxynaphthalen-1-yl) acetate
Canonical SMILES
CC(=O)OC1=C(C(=C(C2=C1C=CC(=C2)Cl)OC(=O)C)OC)OC
InChI Key
IFWMVQUGSGWCRP-UHFFFAOYSA-N
Boiling Point
424.9ºC at 760mmHg
Flash Point
159.3ºC
Density
1.309g/cm³
Exact Mass
338.05600
H-Bond Acceptor
6
H-Bond Donor
0
What is the molecular formula of Lonapalene?

The molecular formula of Lonapalene is C16H15ClO6.

What is the molecular weight of Lonapalene?

The molecular weight of Lonapalene is 338.74 g/mol.

What is the IUPAC name of Lonapalene?

The IUPAC name of Lonapalene is (4-acetyloxy-6-chloro-2,3-dimethoxynaphthalen-1-yl) acetate.

What is the InChI of Lonapalene?

The InChI of Lonapalene is InChI=1S/C16H15ClO6/c1-8(18)22-13-11-6-5-10(17)7-12(11)14(23-9(2)19)16(21-4)15(13)20-3/h5-7H,1-4H3.

What is the InChIKey of Lonapalene?

The InChIKey of Lonapalene is IFWMVQUGSGWCRP-UHFFFAOYSA-N.

What is the Canonical SMILES of Lonapalene?

The Canonical SMILES of Lonapalene is CC(=O)OC1=C(C(=C(C2=C1C=CC(=C2)Cl)OC(=O)C)OC)OC.

What is the CAS number of Lonapalene?

The CAS number of Lonapalene is 91431-42-4.

What is the UNII of Lonapalene?

The UNII of Lonapalene is WIF31Q54NJ.

What is the ChEMBL ID of Lonapalene?

The ChEMBL ID of Lonapalene is CHEMBL36648.

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