Home Aldehydes 6-(difluoromethoxy)-2H-1,3-benzodioxole-5-carbaldehyde

6-(difluoromethoxy)-2H-1,3-benzodioxole-5-carbaldehyde

CAS No.:
1250313-60-0
Catalog Number:
AG019PSU
Molecular Formula:
C9H6F2O4
Molecular Weight:
216.1383
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Product Description
Catalog Number:
AG019PSU
Chemical Name:
6-(difluoromethoxy)-2H-1,3-benzodioxole-5-carbaldehyde
CAS Number:
1250313-60-0
Molecular Formula:
C9H6F2O4
Molecular Weight:
216.1383
MDL Number:
MFCD16061351
IUPAC Name:
6-(difluoromethoxy)-1,3-benzodioxole-5-carbaldehyde
InChI:
InChI=1S/C9H6F2O4/c10-9(11)15-6-2-8-7(13-4-14-8)1-5(6)3-12/h1-3,9H,4H2
InChI Key:
CAPIEPIEIICTKG-UHFFFAOYSA-N
SMILES:
O=Cc1cc2OCOc2cc1OC(F)F
Properties
Complexity:
236  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
216.023g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
216.14g/mol
Monoisotopic Mass:
216.023g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
44.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  
Properties