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Home > Aldehydes > 149949-30-4
149949-30-4 | Benzaldehyde, 2,6-difluoro-3-methoxy-
CAS No: 149949-30-4 Catalog No: AG001M61 MDL No:MFCD04116899
Product Description
Catalog Number:
AG001M61
Chemical Name:
Benzaldehyde, 2,6-difluoro-3-methoxy-
CAS Number:
149949-30-4
Molecular Formula:
C8H6F2O2
Molecular Weight:
172.1288
MDL Number:
MFCD04116899
IUPAC Name:
2,6-difluoro-3-methoxybenzaldehyde
InChI:
InChI=1S/C8H6F2O2/c1-12-7-3-2-6(9)5(4-11)8(7)10/h2-4H,1H3
InChI Key:
WJCGNXHXQFFRKB-UHFFFAOYSA-N
SMILES:
COc1ccc(c(c1F)C=O)F
Properties
Complexity:
163
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
172.034g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
172.131g/mol
Monoisotopic Mass:
172.034g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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