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Details

Stereochemistry ACHIRAL
Molecular Formula C10H12N6
Molecular Weight 216.2425
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 5-(6-AMINO-9H-PURIN-9-YL)PENTANENITRILE

SMILES

NC1=NC=NC2=C1N=CN2CCCCC#N

InChI

InChIKey=LWZINUSWGACPKM-UHFFFAOYSA-N
InChI=1S/C10H12N6/c11-4-2-1-3-5-16-7-15-8-9(12)13-6-14-10(8)16/h6-7H,1-3,5H2,(H2,12,13,14)

HIDE SMILES / InChI

Molecular Formula C10H12N6
Molecular Weight 216.2425
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 14:57:13 GMT 2023
Edited
by admin
on Sat Dec 16 14:57:13 GMT 2023
Record UNII
1DD2PV1OIK
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
5-(6-AMINO-9H-PURIN-9-YL)PENTANENITRILE
Systematic Name English
NSC-74857
Code English
9H-PURINE-9-PENTANENITRILE, 6-AMINO-
Systematic Name English
9H-PURINE-9-VALERONITRILE, 6-AMINO-
Systematic Name English
6-AMINO-9H-PURINE-9-PENTANENITRILE
Systematic Name English
Code System Code Type Description
FDA UNII
1DD2PV1OIK
Created by admin on Sat Dec 16 14:57:13 GMT 2023 , Edited by admin on Sat Dec 16 14:57:13 GMT 2023
PRIMARY
CAS
82222-85-3
Created by admin on Sat Dec 16 14:57:13 GMT 2023 , Edited by admin on Sat Dec 16 14:57:13 GMT 2023
PRIMARY
NSC
74857
Created by admin on Sat Dec 16 14:57:13 GMT 2023 , Edited by admin on Sat Dec 16 14:57:13 GMT 2023
PRIMARY
PUBCHEM
252680
Created by admin on Sat Dec 16 14:57:13 GMT 2023 , Edited by admin on Sat Dec 16 14:57:13 GMT 2023
PRIMARY
EPA CompTox
DTXSID60231636
Created by admin on Sat Dec 16 14:57:13 GMT 2023 , Edited by admin on Sat Dec 16 14:57:13 GMT 2023
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