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141870-15-7 | 1-Naphthalenesulfonic acid, 4-methoxy-
CAS No: 141870-15-7 Catalog No: AG001HA0 MDL No:
Product Description
Catalog Number:
AG001HA0
Chemical Name:
1-Naphthalenesulfonic acid, 4-methoxy-
CAS Number:
141870-15-7
Molecular Formula:
C11H10O4S
Molecular Weight:
238.2597
IUPAC Name:
4-methoxynaphthalene-1-sulfonic acid
InChI:
InChI=1S/C11H10O4S/c1-15-10-6-7-11(16(12,13)14)9-5-3-2-4-8(9)10/h2-7H,1H3,(H,12,13,14)
InChI Key:
NPLRGULPDAYSHW-UHFFFAOYSA-N
SMILES:
COc1ccc(c2c1cccc2)S(=O)(=O)O
EC Number:
282-914-1
Properties
Complexity:
332
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
238.03g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
238.257g/mol
Monoisotopic Mass:
238.03g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
72A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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