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Structure

Adenine acetic acid ethyl ester

CAS
25477-96-7
Catalog Number
ACM25477967
Category
Other Products
Molecular Weight
221.22
Molecular Formula
C9H11 N5 O2

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Specification

Synonyms
Adenine acetic acid ethyl ester;Ethyl adenine-9-acetate;Ethyl 2-(6-amino-9H-purin-9-yl)acetate;Ethyl 6-methylsalicylate
IUPAC Name
ethyl 2-(6-aminopurin-9-yl)acetate
Canonical SMILES
CCOC(=O)CN1C=NC2=C1N=CN=C2N
InChI Key
MCOVDURKZQNFBE-UHFFFAOYSA-N
Boiling Point
443.124ºC at 760 mmHg
Melting Point
224-228ºC (dec.)(lit.)
Flash Point
221.794ºC
Density
1.524g/cm³
Exact Mass
221.09100
H-Bond Acceptor
6
H-Bond Donor
1
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