6-Amino-5-chloropyrimidine-4-carboxylic Acid - CAS 914916-98-6
Catalog: |
BB040215 |
Product Name: |
6-Amino-5-chloropyrimidine-4-carboxylic Acid |
CAS: |
914916-98-6 |
Synonyms: |
6-amino-5-chloro-4-pyrimidinecarboxylic acid; 6-amino-5-chloropyrimidine-4-carboxylic acid |
IUPAC Name: | 6-amino-5-chloropyrimidine-4-carboxylic acid |
Description: | 6-Amino-5-chloropyrimidine-4-carboxylic Acid (CAS# 914916-98-6 ) is a useful research chemical. |
Molecular Weight: | 173.56 |
Molecular Formula: | C5H4ClN3O2 |
Canonical SMILES: | C1=NC(=C(C(=N1)N)Cl)C(=O)O |
InChI: | InChI=1S/C5H4ClN3O2/c6-2-3(5(10)11)8-1-9-4(2)7/h1H,(H,10,11)(H2,7,8,9) |
InChI Key: | XIEDAMQXYCHOHG-UHFFFAOYSA-N |
LogP: | 0.34050 |
Publication Number | Title | Priority Date |
CN-112250666-A | Substituted pyrimidines and their use | 20201009 |
AU-2018276192-A1 | Method for producing optically active compound | 20170530 |
CA-3065683-A1 | Method for producing optically active compound | 20170530 |
CN-111032047-A | Process for producing optically active compound | 20170530 |
EP-3632441-A2 | Method for producing optically active compound | 20170530 |
Complexity: | 166 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 172.9992041 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 172.9992041 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 89.1 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.3 |
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