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Home > Aldehydes > 864437-19-4
864437-19-4 | Benzeneacetaldehyde,2-chloro-4-fluoro-
CAS No: 864437-19-4 Catalog No: AG004QV0 MDL No:MFCD08703376
Product Description
Catalog Number:
AG004QV0
Chemical Name:
Benzeneacetaldehyde,2-chloro-4-fluoro-
CAS Number:
864437-19-4
Molecular Formula:
C8H6ClFO
Molecular Weight:
172.5840
MDL Number:
MFCD08703376
IUPAC Name:
2-(2-chloro-4-fluorophenyl)acetaldehyde
InChI:
InChI=1S/C8H6ClFO/c9-8-5-7(10)2-1-6(8)3-4-11/h1-2,4-5H,3H2
InChI Key:
VXCOWTCRKHIKCQ-UHFFFAOYSA-N
SMILES:
O=CCc1ccc(cc1Cl)F
Properties
Complexity:
140
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
172.009g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
172.583g/mol
Monoisotopic Mass:
172.009g/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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