2-Amino-6-[(2-hydroxyethyl)amino]-4(3H)-pyrimidinone - CAS 1077-04-9
Catalog: |
BB075212 |
Product Name: |
2-Amino-6-[(2-hydroxyethyl)amino]-4(3H)-pyrimidinone |
CAS: |
1077-04-9 |
Synonyms: |
2-amino-6-[(2-hydroxyethyl)amino]pyrimidin-4(1h)-one; 2-amino-4-(2-hydroxyethylamino)-1H-pyrimidin-6-one; 2-Amino-6-((2-hydroxyethyl)amino)pyrimidin-4(3H)-one; 2-amino-6-[(2-hydroxyethyl)amino]pyrimidin-4(3H)-one; 4(3H)-Pyrimidinone,2-amino-6-[(2-hydroxyethyl)amino]- |
IUPAC Name: | 2-amino-4-(2-hydroxyethylamino)-1H-pyrimidin-6-one |
Description: | 2-Amino-6-[(2-hydroxyethyl)amino]-4(3H)-pyrimidinone is a useful reagent in organic synthesis. |
Molecular Weight: | 170.17 |
Molecular Formula: | C6H10N4O2 |
Canonical SMILES: | C1=C(N=C(NC1=O)N)NCCO |
InChI: | InChI=1S/C6H10N4O2/c7-6-9-4(8-1-2-11)3-5(12)10-6/h3,11H,1-2H2,(H4,7,8,9,10,12) |
InChI Key: | BFYURLDNKXKHHL-UHFFFAOYSA-N |
Solubility: | DMSO |
Appearance: | Off-White Solid |
References: | Blazek, Jiri, et al. Bioorg. & Med. Chem., 20(9), 3111-3118 (2012). |
Complexity: | 246 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 170.08037557 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 4 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 170.08037557 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 99.7Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | -1.8 |
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