Home Aldehydes 1017779-48-4
1017779-48-4,MFCD09258695
Catalog No.:AA0005EM
1017779-48-4 | 4-Ethoxy-2,6-difluorobenzaldehyde
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Technical Information
Catalog Number:
AA0005EM
Chemical Name:
4-Ethoxy-2,6-difluorobenzaldehyde
CAS Number:
1017779-48-4
Molecular Formula:
C9H8F2O2
Molecular Weight:
186.1554
MDL Number:
MFCD09258695
IUPAC Name:
4-ethoxy-2,6-difluorobenzaldehyde
InChI:
InChI=1S/C9H8F2O2/c1-2-13-6-3-8(10)7(5-12)9(11)4-6/h3-5H,2H2,1H3
InChI Key:
SHCJRMIWXNHWJF-UHFFFAOYSA-N
SMILES:
CCOc1cc(F)c(c(c1)F)C=O
Properties
Computed Properties
 
Complexity:
163  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
186.049g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
186.158g/mol
Monoisotopic Mass:
186.049g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  

Synonyms
 
4-ethoxy-2,6-difluorobenzaldehyde 
1017779-48-4 
4-Ethoxy-2,6-difluorobenzaldehyde, JRD 
PC302746 
PS-11531 
2,6-DIFLUORO-4-ETHOXYBENZALDEHYDE 
Y3531 
Q-7785 
C9H8F2O2 
MFCD09258695 
Benzaldehyde, 4-ethoxy-2,6-difluoro- 
SCHEMBL8007532 
CTK6G1296 
FCH834920 
SBB090372 
ZINC38529890 
AKOS006282490 
Literature
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