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1996-41-4 | Phenol, 2-chloro-4-fluoro-
CAS No: 1996-41-4 Catalog No: AG002C7Y MDL No:MFCD00002168
Product Description
Catalog Number:
AG002C7Y
Chemical Name:
Phenol, 2-chloro-4-fluoro-
CAS Number:
1996-41-4
Molecular Formula:
C6H4ClFO
Molecular Weight:
146.5468
MDL Number:
MFCD00002168
IUPAC Name:
2-chloro-4-fluorophenol
InChI:
InChI=1S/C6H4ClFO/c7-5-3-4(8)1-2-6(5)9/h1-3,9H
InChI Key:
IGYXYGDEYHNFFT-UHFFFAOYSA-N
SMILES:
Fc1ccc(c(c1)Cl)O
EC Number:
217-876-7
NSC Number:
10273
Properties
Complexity:
99.1
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
145.993g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
146.545g/mol
Monoisotopic Mass:
145.993g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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