[2-(4-Chlorophenoxy)-2-methylpropyl]2-(1,3-dimethyl-2,6-dioxopurin-7-yl)acetate

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Catalog Number
ACM70788271
Product Name
[2-(4-Chlorophenoxy)-2-methylpropyl]2-(1,3-dimethyl-2,6-dioxopurin-7-yl)acetate
Structure
Structure
CAS
70788-27-1
Category
Heterocyclic Organic Compound
Synonyms
Acetylline clofibrol, Acefilina clofibrol, Acefyllinum clofibrolum, Acefylline clofibrol [INN], UNII-WY672D78VW, Acefilina clofibrol [INN-Spanish], Acefyllinum clofibrolum [INN-Latin], CID68898, LS-126435, Theophylline-7-acetate de 2-(p-chlorophenoxy)-2-methylpropyle, Theophylline-7-acetate de 2-(p-chlorophenoxy)-2-methylpropyle [French], 2-(4-Chlorphenoxy)-2-methylpropyl 1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxo-7-purinylacetat, 7H-Purine-7-acetic acid, 1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxo-, 2-(4-chlorophenoxy)-2-methylpropyl ester, 2-(p-Chlorophenoxy)-2-methylpropyl 1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxopurine-7-acetate, 70788-27-1
IUPAC Name
[2-(4-chlorophenoxy)-2-methylpropyl] 2-(1,3-dimethyl-2,6-dioxopurin-7-yl)acetate
Molecular Weight
420.847 g/mol
Molecular Formula
C19H21ClN4O5
Canonical SMILES
CC(C)(COC(=O)CN1C=NC2=C1C(=O)N(C(=O)N2C)C)OC3=CC=C(C=C3)Cl
InChI Key
ICVMNUSJJHSLLM-UHFFFAOYSA-N
Boiling Point
605.3ºC at 760 mmHg
Flash Point
319.9ºC
Density
1.37g/cm³
Exact Mass
420.12000
H-Bond Acceptor
6
H-Bond Donor
0
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