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Structure

4-(6-aminopurin-9-yl)buta-2,3-dien-1-ol

CAS
114987-18-7
Catalog Number
ACM114987187
Category
Other Products
Molecular Weight
203.201 g/mol
Molecular Formula
C9H9N5O

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Specification

Synonyms
Adenallene;
IUPAC Name
4-(6-aminopurin-9-yl)buta-2,3-dien-1-ol
Canonical SMILES
C1=NC2=C(C(=N1)N)N=CN2C=C=CCO
InChI Key
TYQIYCWCVLIXPH-UHFFFAOYSA-N
Boiling Point
552.7ºC at 760mmHg
Flash Point
288.1ºC
Density
1.45g/cm³
Exact Mass
203.08100
H-Bond Acceptor
5
H-Bond Donor
2
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