Home Halogens 3-chloro-5-methoxy-4-propoxybenzaldehyde

3-chloro-5-methoxy-4-propoxybenzaldehyde

CAS No.:
832674-55-2
Catalog Number:
AG00IDAB
Molecular Formula:
C11H13ClO3
Molecular Weight:
228.6721
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Product Description
Catalog Number:
AG00IDAB
Chemical Name:
3-chloro-5-methoxy-4-propoxybenzaldehyde
CAS Number:
832674-55-2
Molecular Formula:
C11H13ClO3
Molecular Weight:
228.6721
MDL Number:
MFCD02256346
IUPAC Name:
3-chloro-5-methoxy-4-propoxybenzaldehyde
InChI:
InChI=1S/C11H13ClO3/c1-3-4-15-11-9(12)5-8(7-13)6-10(11)14-2/h5-7H,3-4H2,1-2H3
InChI Key:
ZBXJCSOGXRWPJJ-UHFFFAOYSA-N
SMILES:
CCCOc1c(Cl)cc(cc1OC)C=O
Properties
Complexity:
198  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
228.055g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
228.672g/mol
Monoisotopic Mass:
228.055g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  
Properties