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1018678-50-6 | Benzaldehyde, 2-(difluoromethyl)-
CAS No: 1018678-50-6 Catalog No: AG0005S2 MDL No:MFCD16875639
Product Description
Catalog Number:
AG0005S2
Chemical Name:
Benzaldehyde, 2-(difluoromethyl)-
CAS Number:
1018678-50-6
Molecular Formula:
C8H6F2O
Molecular Weight:
156.1294
MDL Number:
MFCD16875639
IUPAC Name:
2-(difluoromethyl)benzaldehyde
InChI:
InChI=1S/C8H6F2O/c9-8(10)7-4-2-1-3-6(7)5-11/h1-5,8H
InChI Key:
LRGWXJJJRNOVQA-UHFFFAOYSA-N
SMILES:
O=Cc1ccccc1C(F)F
Properties
Complexity:
136
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:
2.3
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