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CAS Number: 65996-50-1
5H-pyrrolo[3,2-d]pyrimidine-2,4-diol

Structure

 5H-pyrrolo[3,2-d]pyrimidine-2,4-diol
Name: 5H-pyrrolo[3,2-d]pyrimidine-2,4-diol
Synonyms:
General Information
Product Number: 65996501

CAS Registry Number 65996-50-1
Name:
1H-?Pyrrolo[3,?2-?d]?pyrimidine-?2,?4(3H,?5H)?-?dione
5H-Pyrrolo[3,2-d]pyrimidine-2,4-diol

 

Chemical Formula: C6H5N3O2
Exact Mass: 151.04
Molecular Weight: 151.12
m/z: 151.04 (100.0%), 152.04 (7.7%)

 

InChI:InChI=1S/C6H5N3O2/c10-5-4-3(1-2-7-4)8-6(11)9-5/h1-2,7H,(H2,8,9,10,11)

InChI Key:BSRITDQWGPSXPQ-UHFFFAOYSA-N

Canonical SMILES:C1=CNC2=C1NC(=O)NC2=O

 

Thermal Properties Value Condition Note
Melting Point >360 °C Solv: water (7732-18-5) (3)CAS
Melting Point >315 °C   (4)IC
Melting Point >300 °C Solv: methanol (67-56-1) (5)IC
Melting Point See full text   (2)CAS

Specification

98%
References
  1. (2) Abdou, Wafaa M.; Heteroatom Chemistry 2002, V13(4), P357-365 CAPLUS
  2. (3) Imai, Kinichi; Chemical & Pharmaceutical Bulletin 1964, V12(9), P1030-42 CAPLUS
  3. (4) Modnikova, G. A.; Khimiko-Farmatsevticheskii Zhurnal 1988, V22(2), P185-91 CAPLUS
  4. (5) Klein, Robert S.; Journal of Organic Chemistry 1978, V43(12), P2536-9 CAPLUS
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