2,4,6-Trimethylpyrimidine-5-carboxylic Acid - CAS 108397-75-7
Catalog: |
BB002262 |
Product Name: |
2,4,6-Trimethylpyrimidine-5-carboxylic Acid |
CAS: |
108397-75-7 |
Synonyms: |
2,4,6-trimethyl-5-pyrimidinecarboxylic acid; 2,4,6-trimethylpyrimidine-5-carboxylic acid |
IUPAC Name: | 2,4,6-trimethylpyrimidine-5-carboxylic acid |
Description: | 2,4,6-Trimethylpyrimidine-5-carboxylic Acid (CAS# 108397-75-7) is a useful research chemical. |
Molecular Weight: | 166.18 |
Molecular Formula: | C8H10N2O2 |
Canonical SMILES: | CC1=C(C(=NC(=N1)C)C)C(=O)O |
InChI: | InChI=1S/C8H10N2O2/c1-4-7(8(11)12)5(2)10-6(3)9-4/h1-3H3,(H,11,12) |
InChI Key: | DRDANIHGQXLGSQ-UHFFFAOYSA-N |
Storage: | Sealed in dry, 2-8 °C |
LogP: | 1.10000 |
Publication Number | Title | Priority Date |
US-2020109141-A1 | Amino acid compounds and methods of use | 20181008 |
WO-2020076862-A1 | Amino acid compounds and methods of use | 20181008 |
TW-202028179-A | Amino acid compounds and methods of use | 20181008 |
CN-113195053-A | Amino acid compounds and methods of use | 20181008 |
EP-3863711-A1 | Amino acid compounds and methods of use | 20181008 |
Complexity: | 172 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 166.074227566 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 166.074227566 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 63.1 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.9 |
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