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Home > Aldehydes > 1250313-60-0
1250313-60-0 | 6-(difluoromethoxy)-2H-1,3-benzodioxole-5-carbaldehyde
CAS No: 1250313-60-0 Catalog No: AG019PSU MDL No:MFCD16061351
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
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