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5213-17-2 | 4-Fluoro-2-methoxybenzoyl chloride
CAS No: 5213-17-2 Catalog No: AG01EWCA MDL No:MFCD07772787
Product Description
Catalog Number:
AG01EWCA
Chemical Name:
4-Fluoro-2-methoxybenzoyl chloride
CAS Number:
5213-17-2
Molecular Formula:
C8H6ClFO2
Molecular Weight:
188.5834
MDL Number:
MFCD07772787
IUPAC Name:
4-fluoro-2-methoxybenzoyl chloride
InChI:
InChI=1S/C8H6ClFO2/c1-12-7-4-5(10)2-3-6(7)8(9)11/h2-4H,1H3
InChI Key:
KOHPYCKBINGPFW-UHFFFAOYSA-N
SMILES:
COc1cc(F)ccc1C(=O)Cl
Properties
Complexity:
174
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
188.004g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
188.582g/mol
Monoisotopic Mass:
188.004g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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