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Home > Fluorides > 126162-96-7
126162-96-7 | Benzonitrile, 4-ethoxy-2,3-difluoro-
CAS No: 126162-96-7 Catalog No: AG000RWG MDL No:MFCD04973770
Product Description
Catalog Number:
AG000RWG
Chemical Name:
Benzonitrile, 4-ethoxy-2,3-difluoro-
CAS Number:
126162-96-7
Molecular Formula:
C9H7F2NO
Molecular Weight:
183.1548
MDL Number:
MFCD04973770
IUPAC Name:
4-ethoxy-2,3-difluorobenzonitrile
InChI:
InChI=1S/C9H7F2NO/c1-2-13-7-4-3-6(5-12)8(10)9(7)11/h3-4H,2H2,1H3
InChI Key:
NVCHMZSUFSRXTF-UHFFFAOYSA-N
SMILES:
CCOc1ccc(c(c1F)F)C#N
Properties
Complexity:
213
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
183.05g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
183.158g/mol
Monoisotopic Mass:
183.05g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
33A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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