Home > Compound List > Compound details
10167-97-2 molecular structure
click picture or here to close

5-methoxypyridin-2-amine

ChemBase ID: 67804
Molecular Formular: C6H8N2O
Molecular Mass: 124.14052
Monoisotopic Mass: 124.06366289
SMILES and InChIs

SMILES:
c1(ccc(cn1)OC)N
Canonical SMILES:
COc1ccc(nc1)N
InChI:
InChI=1S/C6H8N2O/c1-9-5-2-3-6(7)8-4-5/h2-4H,1H3,(H2,7,8)
InChIKey:
XJKJHILCYUUVSJ-UHFFFAOYSA-N

Cite this record

CBID:67804 http://www.chembase.cn/molecule-67804.html

Collapse All Expand All

NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
5-methoxypyridin-2-amine
IUPAC Traditional name
5-methoxypyridin-2-amine
Synonyms
5-Methoxy-pyridin-2-ylamine
2-Amino-5-methoxypyridine
5-Methoxypyridin-2-amine
CAS Number
10167-97-2
MDL Number
MFCD07374873
PubChem SID
162033539
PubChem CID
11320934

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) -0.3143005  LogD (pH = 7.4) 0.34056833 
Log P 0.3634337  Molar Refractivity 35.3782 cm3
Polarizability 13.0909605 Å3 Polar Surface Area 48.14 Å2
Rotatable Bonds Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Physical Property Safety Information Product Information Bioassay(PubChem)
Solubility
Chloroform expand Show data source
Dichloromethane expand Show data source
Apperance
Dark Red Oil expand Show data source
Boiling Point
128-130°C/10mm expand Show data source
128-130°C/10Torr expand Show data source
Storage Condition
-20°C Freezer, Under Inert Atmosphere expand Show data source
Storage Warning
Harmful/Irritant/Store at -20°C/Store under Argon expand Show data source
IRRITANT expand Show data source
MSDS Link
Download expand Show data source
Download expand Show data source
TSCA Listed
false expand Show data source
Purity
95+% expand Show data source
98% expand Show data source
Certificate of Analysis
Download expand Show data source

DETAILS

DETAILS

REFERENCES

REFERENCES

From Suppliers Google Scholar IconGoogle Scholar PubMed iconPubMed Google Books IconGoogle Books
    No data available
  • Searching...Please wait...

PATENTS

PATENTS

PubChem iconPubChem Patent Google Patent Search IconGoogle Patent

INTERNET

INTERNET

Baidu iconBaidu google iconGoogle