4,6-Dihydroxy-5-methylpyrimidine - CAS 63447-38-1
Catalog: |
BB032153 |
Product Name: |
4,6-Dihydroxy-5-methylpyrimidine |
CAS: |
63447-38-1 |
Synonyms: |
4-hydroxy-5-methyl-1H-pyrimidin-6-one |
IUPAC Name: | 4-hydroxy-5-methyl-1H-pyrimidin-6-one |
Description: | 4,6-Dihydroxy-5-methylpyrimidine (CAS# 63447-38-1) is a compound useful in organic synthesis. |
Molecular Weight: | 126.11 |
Molecular Formula: | C5H6N2O2 |
Canonical SMILES: | CC1=C(N=CNC1=O)O |
InChI: | InChI=1S/C5H6N2O2/c1-3-4(8)6-2-7-5(3)9/h2H,1H3,(H2,6,7,8,9) |
InChI Key: | OREVOAMPEBWISR-UHFFFAOYSA-N |
Boiling Point: | 327.4 °C at 760 mmHg |
Melting Point: | >300 °C; |
Purity: | 98 % |
Density: | 1.44 g/cm3 |
Appearance: | White solid |
Storage: | -20 °C Freezer |
MDL: | MFCD04037280 |
LogP: | 0.19620 |
GHS Hazard Statement: | H318 (100%): Causes serious eye damage [Danger Serious eye damage/eye irritation] |
Precautionary Statement: | P280, P305+P351+P338, and P310 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
WO-2021113938-A1 | Vitamin and mineral food supplement | 20191209 |
BR-102019013196-A2 | NUTRITIONAL SUPPLEMENT | 20190625 |
CN-105457680-A | A Cu composite catalyst used for oxidative carbonylation to synthesize alkyl carbonates | 20151118 |
CN-105457680-B | A kind of Cu composite catalysts for oxidative carbonylation synthesis of alkyl carbonic ester | 20151118 |
JP-2012000602-A | Redox catalyst, electrode catalyst for fuel cell, and fuel cell | 20100621 |
Complexity: | 205 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 126.042927438 |
Formal Charge: | 0 |
Heavy Atom Count: | 9 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 126.042927438 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 61.7 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | -0.5 |
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