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1566758-82-4 | 2,2-DIFLUORO-1-(2-METHOXY-5-METHYLPHENYL)ETHAN-1-ONE
CAS No: 1566758-82-4 Catalog No: AG01BYCB MDL No:MFCD26045125
Product Description
Catalog Number:
AG01BYCB
Chemical Name:
2,2-DIFLUORO-1-(2-METHOXY-5-METHYLPHENYL)ETHAN-1-ONE
CAS Number:
1566758-82-4
Molecular Formula:
C10H10F2O2
Molecular Weight:
200.1820
MDL Number:
MFCD26045125
IUPAC Name:
2,2-difluoro-1-(2-methoxy-5-methylphenyl)ethanone
InChI:
InChI=1S/C10H10F2O2/c1-6-3-4-8(14-2)7(5-6)9(13)10(11)12/h3-5,10H,1-2H3
InChI Key:
IMZMOVCYSBFAJI-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1C(=O)C(F)F)C
Properties
Complexity:
206
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
200.065g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
200.185g/mol
Monoisotopic Mass:
200.065g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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