Home > Compound List > Compound details
6627-60-7 molecular structure
click picture or here to close

(6-methylpyridin-2-yl)methanamine

ChemBase ID: 50379
Molecular Formular: C7H10N2
Molecular Mass: 122.1677
Monoisotopic Mass: 122.08439833
SMILES and InChIs

SMILES:
n1c(CN)cccc1C
Canonical SMILES:
NCc1cccc(n1)C
InChI:
InChI=1S/C7H10N2/c1-6-3-2-4-7(5-8)9-6/h2-4H,5,8H2,1H3
InChIKey:
HXFYXLLVIVSPLT-UHFFFAOYSA-N

Cite this record

CBID:50379 http://www.chembase.cn/molecule-50379.html

Collapse All Expand All

NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
(6-methylpyridin-2-yl)methanamine
IUPAC Traditional name
(6-methylpyridin-2-yl)methanamine
Synonyms
(6-Methyl-2-pyridinyl)methanamine
(6-methylpyridin-2-yl)methanamine
1-(6-methylpyridin-2-yl)methanamine
CAS Number
6627-60-7
MDL Number
MFCD05864530
PubChem SID
162055142
PubChem CID
246721

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) -2.6541448  LogD (pH = 7.4) -1.0896844 
Log P 0.094183885  Molar Refractivity 36.4438 cm3
Polarizability 14.571964 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)
Hydrophobicity(logP)
0.096 expand Show data source
Storage Warning
IRRITANT expand Show data source
MSDS Link
Download expand Show data source
TSCA Listed
false expand Show data source
Purity
95% expand Show data source
95+% 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