5-Chloropyrimidine-2-carboxylic Acid - CAS 38275-61-5
Catalog: |
BB023611 |
Product Name: |
5-Chloropyrimidine-2-carboxylic Acid |
CAS: |
38275-61-5 |
Synonyms: |
5-chloro-2-pyrimidinecarboxylic acid; 5-chloropyrimidine-2-carboxylic acid |
IUPAC Name: | 5-chloropyrimidine-2-carboxylic acid |
Description: | 5-Chloropyrimidine-2-carboxylic Acid (CAS# 38275-61-5) is a useful research chemical. |
Molecular Weight: | 158.54 |
Molecular Formula: | C5H3ClN2O2 |
Canonical SMILES: | C1=C(C=NC(=N1)C(=O)O)Cl |
InChI: | InChI=1S/C5H3ClN2O2/c6-3-1-7-4(5(9)10)8-2-3/h1-2H,(H,9,10) |
InChI Key: | QAHZTYHFUHDFAW-UHFFFAOYSA-N |
LogP: | 0.82820 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
WO-2021032687-A1 | Antimalarial hexahydropyrimidine analogues | 20190819 |
CN-111825657-A | Dual-function chimeric heterocyclic compound for targeted degradation of androgen receptor and application thereof | 20190418 |
WO-2020211822-A1 | A class of bifunctional chimeric heterocyclic compounds for targeted degradation of androgen receptors and use thereof | 20190418 |
WO-2020085234-A1 | Morphinan derivative | 20181022 |
US-2020048242-A1 | Dihydropyrimidine derivatives and uses thereof in the treatment of hbv infection or of hbv-induced diseases | 20180809 |
Complexity: | 134 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 157.9883050 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 157.9883050 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 63.1 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.7 |
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