6-Bromopyrazine-2-carboxylic Acid - CAS 1196151-53-7
Catalog: |
BB004539 |
Product Name: |
6-Bromopyrazine-2-carboxylic Acid |
CAS: |
1196151-53-7 |
Synonyms: |
6-bromo-2-pyrazinecarboxylic acid; 6-bromopyrazine-2-carboxylic acid |
IUPAC Name: | 6-bromopyrazine-2-carboxylic acid |
Description: | 6-Bromopyrazine-2-carboxylic Acid (CAS# 1196151-53-7 ) is a useful research chemical. |
Molecular Weight: | 202.99 |
Molecular Formula: | C5H3BrN2O2 |
Canonical SMILES: | C1=C(N=C(C=N1)Br)C(=O)O |
InChI: | InChI=1S/C5H3BrN2O2/c6-4-2-7-1-3(8-4)5(9)10/h1-2H,(H,9,10) |
InChI Key: | HKGHXDMQMSAZSQ-UHFFFAOYSA-N |
Storage: | Inert atmosphere, 2-8 °C |
LogP: | 0.93730 |
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-2020030925-A1 | Heterocyclic substituted ureas, for use against cancer | 20180810 |
EP-3402799-A1 | Heterocyclic compounds as rsv inhibitors | 20160115 |
US-2017226129-A1 | Heterocyclic compounds as rsv inhibitors | 20160115 |
WO-2017123884-A1 | Heterocyclic compounds as rsv inhibitors | 20160115 |
EP-2753618-A1 | Heterocyclic-substitued benzofuran derivatives and methods of use thereof for the treatment of viral diseases | 20110908 |
Complexity: | 142 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 201.93779 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 201.93779 |
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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