Home > Compound List > Compound details
306279-65-2 molecular structure
click picture or here to close

N-(2-ethoxyphenyl)-2-methoxybenzamide

ChemBase ID: 300975
Molecular Formular: C16H17NO3
Molecular Mass: 271.31108
Monoisotopic Mass: 271.12084341
SMILES and InChIs

SMILES:
CCOc1ccccc1NC(=O)c1ccccc1OC
Canonical SMILES:
CCOc1ccccc1NC(=O)c1ccccc1OC
InChI:
InChI=1S/C16H17NO3/c1-3-20-15-11-7-5-9-13(15)17-16(18)12-8-4-6-10-14(12)19-2/h4-11H,3H2,1-2H3,(H,17,18)
InChIKey:
IFOHCGGZEGVBME-UHFFFAOYSA-N

Cite this record

CBID:300975 http://www.chembase.cn/molecule-300975.html

Collapse All Expand All

NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
N-(2-ethoxyphenyl)-2-methoxybenzamide
IUPAC Traditional name
N-(2-ethoxyphenyl)-2-methoxybenzamide
Synonyms
N-(2-Ethoxyphenyl)-2-methoxybenzamide
CAS Number
306279-65-2
MDL Number
MFCD01010708

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID
Alfa Aesar H59799 external link Add to cart
Data Source Data ID Price
Alfa Aesar
H59799 external link Add to cart Please log in.
Data Source Data ID

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
Acid pKa 12.986994  H Acceptors
H Donor LogD (pH = 5.5) 3.106596 
LogD (pH = 7.4) 3.106595  Log P 3.106596 
Molar Refractivity 79.2665 cm3 Polarizability 29.81347 Å3
Polar Surface Area 47.56 Å2 Rotatable Bonds
Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Safety Information Product Information Bioassay(PubChem)
European Hazard Symbols
Irritant Irritant (Xi) expand Show data source
Risk Statements
36/37/38 expand Show data source
Safety Statements
26-37-60 expand Show data source
TSCA Listed
expand Show data source
GHS Pictograms
GHS07 expand Show data source
GHS Hazard statements
H315-H319-H335 expand Show data source
GHS Precautionary statements
P261-P305+P351+P338-P302+P352-P321-P405-P501 expand Show data source
Purity
97% 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