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1879026-06-8 | 4-CHLORO-2,3-DIFLUORO-5-METHOXYBENZALDEHYDE
CAS No: 1879026-06-8 Catalog No: AG01E653 MDL No:
Product Description
Catalog Number:
AG01E653
Chemical Name:
4-CHLORO-2,3-DIFLUORO-5-METHOXYBENZALDEHYDE
CAS Number:
1879026-06-8
Molecular Formula:
C8H5ClF2O2
Molecular Weight:
206.5739
IUPAC Name:
4-chloro-2,3-difluoro-5-methoxybenzaldehyde
InChI:
InChI=1S/C8H5ClF2O2/c1-13-5-2-4(3-12)7(10)8(11)6(5)9/h2-3H,1H3
InChI Key:
MMVKNQVXCPGQLL-UHFFFAOYSA-N
SMILES:
COc1cc(C=O)c(c(c1Cl)F)F
Properties
Complexity:
191
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
205.995g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
206.573g/mol
Monoisotopic Mass:
205.995g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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