Home Aldehydes 100256-89-1
100256-89-1,MFCD05263779
Catalog No.:AA0001B7
100256-89-1 | 3-Ethoxy-2-propoxybenzaldehyde
Pack Size
Purity
Availability
Price(USD)
Quantity
  
250mg
95.0%
3 weeks  
$176.00   $123.00
- +
500mg
95.0%
3 weeks  
$266.00   $187.00
- +
1g
95.0%
3 weeks  
$371.00   $260.00
- +
  • Technical Information
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Technical Information
Catalog Number:
AA0001B7
Chemical Name:
3-Ethoxy-2-propoxybenzaldehyde
CAS Number:
100256-89-1
Molecular Formula:
C12H16O3
Molecular Weight:
208.2536
MDL Number:
MFCD05263779
IUPAC Name:
3-ethoxy-2-propoxybenzaldehyde
InChI:
InChI=1S/C12H16O3/c1-3-8-15-12-10(9-13)6-5-7-11(12)14-4-2/h5-7,9H,3-4,8H2,1-2H3
InChI Key:
NGLILBQTESXZCG-UHFFFAOYSA-N
SMILES:
CCCOc1c(OCC)cccc1C=O
Properties
Computed Properties
 
Complexity:
182  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
208.11g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
208.257g/mol
Monoisotopic Mass:
208.11g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  

Synonyms
 
3-ethoxy-2-propoxybenzaldehyde 
100256-89-1 
ZINC3887665 
AKOS008963581 
MCULE-3957836740 
NE29130 
RT-008722 
EN300-09140 
ZINC03887665 
CID3851394 
Benzaldehyde,3-ethoxy-2-propoxy- 
AC1Q2YBE 
ACMC-1BSS8 
AC1MY5C6 
3-ethoxy-2-propoxy-benzaldehyde 
CTK3J8701 
DTXSID30397314 
Benzaldehyde, 3-ethoxy-2-propoxy- 
Literature
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