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832677-76-6 | 2-CHLORO-5-METHOXY-4-PROPOXYBENZALDEHYDE
CAS No: 832677-76-6 Catalog No: AG004YY8 MDL No:MFCD02379921
Product Description
Catalog Number:
AG004YY8
Chemical Name:
2-CHLORO-5-METHOXY-4-PROPOXYBENZALDEHYDE
CAS Number:
832677-76-6
Molecular Formula:
C11H13ClO3
Molecular Weight:
228.6721
MDL Number:
MFCD02379921
IUPAC Name:
2-chloro-5-methoxy-4-propoxybenzaldehyde
InChI:
InChI=1S/C11H13ClO3/c1-3-4-15-11-6-9(12)8(7-13)5-10(11)14-2/h5-7H,3-4H2,1-2H3
InChI Key:
VCEIJWMWXADXLH-UHFFFAOYSA-N
SMILES:
CCCOc1cc(Cl)c(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
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