3-Amino-6-methylpyridin-2(1H)-one - CAS 52334-79-9
Catalog: |
BB027794 |
Product Name: |
3-Amino-6-methylpyridin-2(1H)-one |
CAS: |
52334-79-9 |
Synonyms: |
3-amino-6-methyl-1H-pyridin-2-one; 3-amino-6-methyl-1H-pyridin-2-one |
IUPAC Name: | 3-amino-6-methyl-1H-pyridin-2-one |
Description: | 3-Amino-6-methylpyridin-2(1H)-one (CAS# 52334-79-9) is a useful research chemical. |
Molecular Weight: | 124.14 |
Molecular Formula: | C6H8N2O |
Canonical SMILES: | CC1=CC=C(C(=O)N1)N |
InChI: | InChI=1S/C6H8N2O/c1-4-2-3-5(7)6(9)8-4/h2-3H,7H2,1H3,(H,8,9) |
InChI Key: | OPTKLLIHUWHIFL-UHFFFAOYSA-N |
Boiling Point: | 370.2 °C at 760 mmHg |
Density: | 1.245 g/cm3 |
MDL: | MFCD07774135 |
LogP: | 1.25900 |
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-2020033784-A1 | Transglutaminase 2 (tg2) inhibitors | 20180810 |
TW-202023553-A | Transglutaminase 2 (tg2) inhibitors | 20180810 |
AU-2019318543-A1 | Transglutaminase 2 (TG2) inhibitors | 20180810 |
CN-112789040-A | Transglutaminase 2(TG2) inhibitors | 20180810 |
EP-3833348-A1 | Transglutaminase 2 (tg2) inhibitors | 20180810 |
Complexity: | 203 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 124.063662883 |
Formal Charge: | 0 |
Heavy Atom Count: | 9 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 124.063662883 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 55.1 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.1 |
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Amines and Anilines
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