Home > Compound List > Compound details
768-61-6 molecular structure
click picture or here to close

(5-ethylpyridin-2-yl)methanol

ChemBase ID: 307122
Molecular Formular: C8H11NO
Molecular Mass: 137.17904
Monoisotopic Mass: 137.08406398
SMILES and InChIs

SMILES:
n1c(ccc(c1)CC)CO
Canonical SMILES:
CCc1ccc(nc1)CO
InChI:
InChI=1S/C8H11NO/c1-2-7-3-4-8(6-10)9-5-7/h3-5,10H,2,6H2,1H3
InChIKey:
LIRQOUKPZWQBRE-UHFFFAOYSA-N

Cite this record

CBID:307122 http://www.chembase.cn/molecule-307122.html

Collapse All Expand All

NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
(5-ethylpyridin-2-yl)methanol
IUPAC Traditional name
(5-ethylpyridin-2-yl)methanol
Synonyms
(5-ethylpyridin-2-yl)methanol
CAS Number
768-61-6
MDL Number
MFCD08059843

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID
ChemBridge 4011741 external link Add to cart
Data Source Data ID Price
ChemBridge
4011741 external link Add to cart Please log in.
Data Source Data ID

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) 0.87224793  LogD (pH = 7.4) 1.0253019 
Log P 1.0276855  Molar Refractivity 39.837 cm3
Polarizability 15.489028 Å3 Polar Surface Area 33.12 Å2

PROPERTIES

PROPERTIES

Bioassay(PubChem)

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