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Home > Fluorides > 177787-22-3
177787-22-3 | 4-Cyano-3-fluorobenzoyl chloride
CAS No: 177787-22-3 Catalog No: AG01FEQY MDL No:
Product Description
Catalog Number:
AG01FEQY
Chemical Name:
4-Cyano-3-fluorobenzoyl chloride
CAS Number:
177787-22-3
Molecular Formula:
C8H3ClFNO
Molecular Weight:
183.5669
IUPAC Name:
4-cyano-3-fluorobenzoyl chloride
InChI:
InChI=1S/C8H3ClFNO/c9-8(12)5-1-2-6(4-11)7(10)3-5/h1-3H
InChI Key:
UCMPFBWQSCDQMY-UHFFFAOYSA-N
SMILES:
N#Cc1ccc(cc1F)C(=O)Cl
Properties
Complexity:
235
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
182.989g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
183.566g/mol
Monoisotopic Mass:
182.989g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
40.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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