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19013-30-0 | Phenol, 4-methoxy-, 1-methanesulfonate
CAS No: 19013-30-0 Catalog No: AG002ECW MDL No:MFCD01231360
Product Description
Catalog Number:
AG002ECW
Chemical Name:
Phenol, 4-methoxy-, 1-methanesulfonate
CAS Number:
19013-30-0
Molecular Formula:
C8H10O4S
Molecular Weight:
202.2276
MDL Number:
MFCD01231360
IUPAC Name:
(4-methoxyphenyl) methanesulfonate
InChI:
InChI=1S/C8H10O4S/c1-11-7-3-5-8(6-4-7)12-13(2,9)10/h3-6H,1-2H3
InChI Key:
BZKNVCHUULQHAT-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)OS(=O)(=O)C
Properties
Complexity:
233
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
202.03g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
202.224g/mol
Monoisotopic Mass:
202.03g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
61A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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