Home > Compound List > Compound details
41995-31-7 molecular structure
click picture or here to close

3-ethyl-6-methylpyridin-2-amine

ChemBase ID: 295528
Molecular Formular: C8H12N2
Molecular Mass: 136.19428
Monoisotopic Mass: 136.10004839
SMILES and InChIs

SMILES:
CCc1ccc(nc1N)C
Canonical SMILES:
CCc1ccc(nc1N)C
InChI:
InChI=1S/C8H12N2/c1-3-7-5-4-6(2)10-8(7)9/h4-5H,3H2,1-2H3,(H2,9,10)
InChIKey:
OQNDNGDJFBXUID-UHFFFAOYSA-N

Cite this record

CBID:295528 http://www.chembase.cn/molecule-295528.html

Collapse All Expand All

NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
3-ethyl-6-methylpyridin-2-amine
IUPAC Traditional name
3-ethyl-6-methylpyridin-2-amine
Synonyms
3-Ethyl-6-methyl-2-pyridinamine
2-Amino-3-ethyl-6-methylpyridine
2-AMINO-3-ETHYL-6-METHYLPYRIDINE
2-氨基-3-乙基-6-甲基吡啶
CAS Number
41995-31-7
EC Number
255-614-3
MDL Number
MFCD00130077
PubChem SID
180681059
PubChem CID
3016311

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID
PubChem 3016311 external link

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) -0.22412637  LogD (pH = 7.4) 0.9767363 
Log P 1.6104652  Molar Refractivity 43.1487 cm3
Polarizability 15.944203 Å3 Polar Surface Area 38.91 Å2
Rotatable Bonds Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Physical Property Safety Information Product Information Bioassay(PubChem)
Melting Point
45-48°C expand Show data source
European Hazard Symbols
X expand Show data source
UN Number
UN2811 expand Show data source
Hazard Class
6.1 expand Show data source
Packing Group
III expand Show data source
Risk Statements
20/21/22-36/38 expand Show data source
Safety Statements
26-36/37 expand Show data source
TSCA Listed
expand Show data source
GHS Pictograms
GHS06 expand Show data source
GHS Hazard statements
H331-H302-H312-H315-H319 expand Show data source
GHS Precautionary statements
P261-P305+P351+P338-P302+P352-P321-P405-P501A expand Show data source
Purity
97% expand Show data source
98% 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