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Home > Aldehydes > 1256477-62-9
1256477-62-9 | (2-Chloro-3,6-difluorophenyl)acetaldehyde
CAS No: 1256477-62-9 Catalog No: AG01ERAU MDL No:
Product Description
Catalog Number:
AG01ERAU
Chemical Name:
(2-Chloro-3,6-difluorophenyl)acetaldehyde
CAS Number:
1256477-62-9
Molecular Formula:
C8H5ClF2O
Molecular Weight:
190.5745
IUPAC Name:
2-(2-chloro-3,6-difluorophenyl)acetaldehyde
InChI:
InChI=1S/C8H5ClF2O/c9-8-5(3-4-12)6(10)1-2-7(8)11/h1-2,4H,3H2
InChI Key:
YMMVIHLNHQBDKK-UHFFFAOYSA-N
SMILES:
O=CCc1c(F)ccc(c1Cl)F
Properties
Complexity:
165
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:
2.1
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