2-Amino-2-(3-pyridyl)ethanol Dihydrochloride - CAS 1187930-70-6
Catalog: |
BB004276 |
Product Name: |
2-Amino-2-(3-pyridyl)ethanol Dihydrochloride |
CAS: |
1187930-70-6 |
Synonyms: |
2-amino-2-(3-pyridinyl)ethanol;dihydrochloride; 2-amino-2-pyridin-3-ylethanol;dihydrochloride |
IUPAC Name: | 2-amino-2-pyridin-3-ylethanol;dihydrochloride |
Description: | 2-Amino-2-(3-pyridyl)ethanol Dihydrochloride (CAS# 1187930-70-6) is a useful research chemical. |
Molecular Weight: | 211.09 |
Molecular Formula: | C7H12Cl2N2O |
Canonical SMILES: | C1=CC(=CN=C1)C(CO)N.Cl.Cl |
InChI: | InChI=1S/C7H10N2O.2ClH/c8-7(5-10)6-2-1-3-9-4-6;;/h1-4,7,10H,5,8H2;2*1H |
InChI Key: | CEJDBJMKRRFMGK-UHFFFAOYSA-N |
Storage: | Inert atmosphere, Room Temperature |
LogP: | 2.37800 |
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 |
AU-2018325451-A1 | Compounds and methods for modulating adenosine A2B receptor and adenosine A2A receptor | 20170831 |
WO-2019046784-A1 | COMPOUNDS AND METHODS FOR MODULATION OF A2B RECEPTOR OF ADENOSINE AND A2A RECEPTOR OF ADENOSINE | 20170831 |
CN-111629728-A | Compounds and methods for modulating adenosine A2B receptor and adenosine A2A receptor | 20170831 |
EP-3675856-A1 | Compounds and methods for modulating adenosine a2b receptor and adenosine a2a receptor | 20170831 |
JP-2020532541-A | Compounds and methods for regulating adenosine A2B and adenosine A2A receptors | 20170831 |
Complexity: | 97.6 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 3 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 210.0326684 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 4 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 210.0326684 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 59.1 Å2 |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
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