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Home > Aldehydes > 286474-59-7
286474-59-7 | Benzaldehyde, 6-chloro-2-fluoro-3-methyl-
CAS No: 286474-59-7 Catalog No: AG002VYY MDL No:MFCD01631370
Product Description
Catalog Number:
AG002VYY
Chemical Name:
Benzaldehyde, 6-chloro-2-fluoro-3-methyl-
CAS Number:
286474-59-7
Molecular Formula:
C8H6ClFO
Molecular Weight:
172.5840
MDL Number:
MFCD01631370
IUPAC Name:
6-chloro-2-fluoro-3-methylbenzaldehyde
InChI:
InChI=1S/C8H6ClFO/c1-5-2-3-7(9)6(4-11)8(5)10/h2-4H,1H3
InChI Key:
GGZOMBUJFMOEEZ-UHFFFAOYSA-N
SMILES:
O=Cc1c(Cl)ccc(c1F)C
Properties
Complexity:
151
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:
1
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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