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1378878-84-2 | 3,5-Difluorophenethyl acetate
CAS No: 1378878-84-2 Catalog No: AG01FF67 MDL No:
Product Description
Catalog Number:
AG01FF67
Chemical Name:
3,5-Difluorophenethyl acetate
CAS Number:
1378878-84-2
Molecular Formula:
C10H10F2O2
Molecular Weight:
200.1820
IUPAC Name:
2-(3,5-difluorophenyl)ethyl acetate
InChI:
InChI=1S/C10H10F2O2/c1-7(13)14-3-2-8-4-9(11)6-10(12)5-8/h4-6H,2-3H2,1H3
InChI Key:
BRDDXZLQZRHSFK-UHFFFAOYSA-N
SMILES:
CC(=O)OCCc1cc(F)cc(c1)F
Properties
Complexity:
187
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:
4
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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