CAS Registry Number®
1839-18-5
CAS Name
2-Chloroadenine
Molecular Formula
C5H4ClN5
Molecular Mass
169.57
Compound Properties
-
Melting Point (1)
>300 °C
Source(s)
- (1) Roitshtein, L. M.; Zhurnal Obshchei Khimii, (1969), 39(9), 2125-9, CAplus
Other Names and Identifiers
InChI
InChI=1S/C5H4ClN5/c6-5-10-3(7)2-4(11-5)9-1-8-2/h1H,(H3,7,8,9,10,11)
InChIKey
InChIKey=HBJGQJWNMZDFKL-UHFFFAOYSA-N
SMILES
NC1=C2C(=NC(Cl)=N1)N=CN2
Canonical SMILES
ClC1=NC=2N=CNC2C(=N1)N
Other Names for this Substance
- 9H-Purin-6-amine, 2-chloro-
- Adenine, 2-chloro-
- 1H-Purin-6-amine, 2-chloro-
- 2-Chloro-9H-purin-6-amine
- 2-Chloroadenine
- 6-Amino-2-chloropurine
- SQ 22982
- 2-Chloro-6-aminopurine
- NSC 7362
- 6-Amino-2-chloro-9H-purine
- 2-Chloro-1H-purin-6-amine
- 2-Chloro-7H-purin-6-amine
Deleted or Replaced CAS Registry Numbers
31458-56-7
