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443-26-5 | Ethyl 2-fluorobenzoate
CAS No: 443-26-5 Catalog No: AG003HBJ MDL No:MFCD00039214
Product Description
Catalog Number:
AG003HBJ
Chemical Name:
Ethyl 2-fluorobenzoate
CAS Number:
443-26-5
Molecular Formula:
C9H9FO2
Molecular Weight:
168.1650
MDL Number:
MFCD00039214
IUPAC Name:
ethyl 2-fluorobenzoate
InChI:
InChI=1S/C9H9FO2/c1-2-12-9(11)7-5-3-4-6-8(7)10/h3-6H,2H2,1H3
InChI Key:
RUWPGPOBTHOLHF-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1ccccc1F
EC Number:
207-134-0
NSC Number:
67340
Properties
Complexity:
159
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
168.059g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
168.167g/mol
Monoisotopic Mass:
168.059g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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