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1582-01-0 | Phenol, 4-fluoro-, 1-(4-methylbenzenesulfonate)
CAS No: 1582-01-0 Catalog No: AG001Q1T MDL No:
Product Description
Catalog Number:
AG001Q1T
Chemical Name:
Phenol, 4-fluoro-, 1-(4-methylbenzenesulfonate)
CAS Number:
1582-01-0
IUPAC Name:
4-fluorophenol;4-methylbenzenesulfonic acid
InChI:
InChI=1S/C7H8O3S.C6H5FO/c1-6-2-4-7(5-3-6)11(8,9)10;7-5-1-3-6(8)4-2-5/h2-5H,1H3,(H,8,9,10);1-4,8H
InChI Key:
NCTLFBPXRJNCIZ-UHFFFAOYSA-N
Properties
Complexity:
273
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
284.052g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
284.301g/mol
Monoisotopic Mass:
284.052g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
83A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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