Home Aldehydes Benzaldehyde,2,4,5-triethoxy-

Benzaldehyde,2,4,5-triethoxy-

CAS No.:
67827-54-7
Catalog Number:
AG006IWL
Molecular Formula:
C13H18O4
Molecular Weight:
238.2796
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Product Description
Catalog Number:
AG006IWL
Chemical Name:
Benzaldehyde,2,4,5-triethoxy-
CAS Number:
67827-54-7
Molecular Formula:
C13H18O4
Molecular Weight:
238.2796
MDL Number:
MFCD00021054
IUPAC Name:
2,4,5-triethoxybenzaldehyde
InChI:
InChI=1S/C13H18O4/c1-4-15-11-8-13(17-6-3)12(16-5-2)7-10(11)9-14/h7-9H,4-6H2,1-3H3
InChI Key:
OQEPUQXAJPNVFJ-UHFFFAOYSA-N
SMILES:
CCOc1cc(OCC)c(cc1OCC)C=O
Properties
Complexity:
220  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
238.121g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
238.283g/mol
Monoisotopic Mass:
238.121g/mol
Rotatable Bond Count:
7  
Topological Polar Surface Area:
44.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  
Properties