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1017777-60-4 | Phenol, 2-chloro-6-fluoro-3-methoxy-
CAS No: 1017777-60-4 Catalog No: AG0005GA MDL No:MFCD09832266
Product Description
Catalog Number:
AG0005GA
Chemical Name:
Phenol, 2-chloro-6-fluoro-3-methoxy-
CAS Number:
1017777-60-4
Molecular Formula:
C7H6ClFO2
Molecular Weight:
176.5727
MDL Number:
MFCD09832266
IUPAC Name:
2-chloro-6-fluoro-3-methoxyphenol
InChI:
InChI=1S/C7H6ClFO2/c1-11-5-3-2-4(9)7(10)6(5)8/h2-3,10H,1H3
InChI Key:
YJSDVAWUSTVUQS-UHFFFAOYSA-N
SMILES:
COc1ccc(c(c1Cl)O)F
Properties
Complexity:
134
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
176.004g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
176.571g/mol
Monoisotopic Mass:
176.004g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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