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138950-84-2 | Benzaldehyde, (chlorodifluoromethyl)- (9CI)
CAS No: 138950-84-2 Catalog No: AG0019WJ MDL No:
Product Description
Catalog Number:
AG0019WJ
Chemical Name:
Benzaldehyde, (chlorodifluoromethyl)- (9CI)
CAS Number:
138950-84-2
Molecular Formula:
C8H5ClF2O
Molecular Weight:
190.5745
IUPAC Name:
2-[chloro(difluoro)methyl]benzaldehyde
InChI:
InChI=1S/C8H5ClF2O/c9-8(10,11)7-4-2-1-3-6(7)5-12/h1-5H
InChI Key:
CAROVVDPLIKTLG-UHFFFAOYSA-N
SMILES:
O=Cc1ccccc1C(Cl)(F)F
Properties
Complexity:
172
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
190g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
190.574g/mol
Monoisotopic Mass:
190g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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