2-amino-5-bromonicotinic acid - CAS 52833-94-0
Catalog: |
BB027961 |
Product Name: |
2-amino-5-bromonicotinic acid |
CAS: |
52833-94-0 |
Synonyms: |
2-amino-5-bromo-3-pyridinecarboxylic acid; 2-amino-5-bromopyridine-3-carboxylic acid |
IUPAC Name: | 2-amino-5-bromopyridine-3-carboxylic acid |
Description: | 2-amino-5-bromonicotinic acid (CAS# 52833-94-0) is a useful research chemical. |
Molecular Weight: | 217.02 |
Molecular Formula: | C6H5BrN2O2 |
Canonical SMILES: | C1=C(C(=NC=C1Br)N)C(=O)O |
InChI: | InChI=1S/C6H5BrN2O2/c7-3-1-4(6(10)11)5(8)9-2-3/h1-2H,(H2,8,9)(H,10,11) |
InChI Key: | IEPDTLRHISNBLB-UHFFFAOYSA-N |
Boiling Point: | 350.4 °C at 760 mmHg |
Purity: | 97.0 % |
Density: | 1.909 g/cm3 |
MDL: | MFCD01860227 |
LogP: | 1.70570 |
GHS Hazard Statement: | H302+H312+H332 (50%): Harmful if swallowed, in contact with skin or if inhaled [Warning Acute toxicity, oral; acute toxicity, dermal; acute toxicity, inhalation] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
WO-2021127071-A1 | Bicyclic heterocycle compounds methods of use thereof for the treatment of herpes viruses | 20191218 |
WO-2021069339-A1 | Homopiperazinyl and homopiperidinyl quinazolin-4(3h)-one derivatives having multimodal activity against pain | 20191010 |
WO-2021064571-A1 | N-substituted-4-oxo-3,4-dihydropyrido[2,3-d]pyrimidin-2-yl derivatives as inhibitors of the human immunodeficiency virus replication | 20191001 |
WO-2021041973-A1 | Perk inhibiting compounds | 20190829 |
WO-2021041976-A1 | Perk inhibiting indolinyl compounds | 20190829 |
Complexity: | 165 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 215.95344 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 215.95344 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 76.2 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.3 |
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