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CAS Number: 698-30-6
5-(hydroxymethyl)-2-methylpyrimidin-4(3H)-one

Structure

5-(hydroxymethyl)-2-methylpyrimidin-4(3H)-one
Name: 5-(hydroxymethyl)-2-methylpyrimidin-4(3H)-one
Synonyms:
General Information
Product Number: 698306
CAS Registry Number: 698-30-6
Name:
        4(3H)​-​Pyrimidinone, 5-​(hydroxymethyl)​-​2-​methyl-
        4(1H)​-​Pyrimidinone, 5-​(hydroxymethyl)​-​2-​methyl- (9CI); 5-​Pyrimidinemethanol, 4-​hydroxy-​2-​methyl- (6CI,​7CI,​8CI); 2-​Methyl-​4-​hydroxy-​5-​hydroxymethylpyrimid​ine; Oxy-​Pm 
 
Chemical Formula: C6H8N2O2
Exact Mass: 140.06
Molecular Weight: 140.14
m/z: 140.06 (100.0%), 141.06 (7.4%)
Elemental Analysis: C, 51.42; H, 5.75; N, 19.99; O, 22.83
 
InChI: InChI=1S/C6H8N2O2/c1-4-7-2-5(3-9)6(10)8-4/h2,9H,3H2,1H3,(H,7,8,10)
InChIKey: ATTZFOQANXUZIP-UHFFFAOYSA-N
Canonical SMILES : CC1=NC=C(C(=O)N1)CO
 
Thermal Properties Value Condition Note
Melting Point 215 °C   (3)CAS
Melting Point 213-215 °C Solv: 1,4-dioxane (123-91-1) (1)IC

Specification

98%

References
  1. (1) Baxter, Robert L.; Journal of the Chemical Society, Perkin Transactions 1: Organic and Bio-Organic Chemistry (1972-1999) 1990, (11), P2963-6 CAPLUS
  2. (2) Bushma, M. I.; Farmakol. Toksikol. Nov. Prod. Khim. Sint., Mater. Resp. Konf., 3rd 1975, P8 CAPLUS
  3. (3) Cerecedo, Leopold R.; Journal of the American Chemical Society 1937, V59, P1714-16 CAPLUS
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