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Home > Aldehydes > 111991-18-5
111991-18-5 | 2-(2,4-difluorophenyl)acetaldehyde
CAS No: 111991-18-5 Catalog No: AG01A5UY MDL No:MFCD02261743
Product Description
Catalog Number:
AG01A5UY
Chemical Name:
2-(2,4-difluorophenyl)acetaldehyde
CAS Number:
111991-18-5
Molecular Formula:
C8H6F2O
Molecular Weight:
156.1294
MDL Number:
MFCD02261743
IUPAC Name:
2-(2,4-difluorophenyl)acetaldehyde
InChI:
InChI=1S/C8H6F2O/c9-7-2-1-6(3-4-11)8(10)5-7/h1-2,4-5H,3H2
InChI Key:
IHVSYWJHPZKJAN-UHFFFAOYSA-N
SMILES:
O=CCc1ccc(cc1F)F
Properties
Complexity:
138
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
156.039g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
156.132g/mol
Monoisotopic Mass:
156.039g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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