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Home > Aldehydes > 747411-54-7
747411-54-7 | 3-chloro-4-(difluoromethoxy)-5-methoxybenzaldehyde
CAS No: 747411-54-7 Catalog No: AG019JIQ MDL No:MFCD05270919
Product Description
Catalog Number:
AG019JIQ
Chemical Name:
3-chloro-4-(difluoromethoxy)-5-methoxybenzaldehyde
CAS Number:
747411-54-7
Molecular Formula:
C9H7ClF2O3
Molecular Weight:
236.5999
MDL Number:
MFCD05270919
IUPAC Name:
3-chloro-4-(difluoromethoxy)-5-methoxybenzaldehyde
InChI:
InChI=1S/C9H7ClF2O3/c1-14-7-3-5(4-13)2-6(10)8(7)15-9(11)12/h2-4,9H,1H3
InChI Key:
RVOXHQRAIULOAJ-UHFFFAOYSA-N
SMILES:
O=Cc1cc(Cl)c(c(c1)OC)OC(F)F
Properties
Complexity:
216
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
236.005g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
236.599g/mol
Monoisotopic Mass:
236.005g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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