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Home > Aldehydes > 1256477-03-8
1256477-03-8 | (2,6-Difluoro-3-methylphenyl)acetaldehyde
CAS No: 1256477-03-8 Catalog No: AG01ERAT MDL No:
Product Description
Catalog Number:
AG01ERAT
Chemical Name:
(2,6-Difluoro-3-methylphenyl)acetaldehyde
CAS Number:
1256477-03-8
Molecular Formula:
C9H8F2O
Molecular Weight:
170.1560
IUPAC Name:
2-(2,6-difluoro-3-methylphenyl)acetaldehyde
InChI:
InChI=1S/C9H8F2O/c1-6-2-3-8(10)7(4-5-12)9(6)11/h2-3,5H,4H2,1H3
InChI Key:
MGNQYTOEJIWIOC-UHFFFAOYSA-N
SMILES:
O=CCc1c(F)ccc(c1F)C
Properties
Complexity:
161
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
170.054g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
170.159g/mol
Monoisotopic Mass:
170.054g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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