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98-30-6

98-30-6 | 4-Methylsulfonyl-2-aminophenol

CAS No: 98-30-6 Catalog No: AG003IVP MDL No:MFCD00719450

Product Description

Catalog Number:
AG003IVP
Chemical Name:
4-Methylsulfonyl-2-aminophenol
CAS Number:
98-30-6
Molecular Formula:
C7H9NO3S
Molecular Weight:
187.2163
MDL Number:
MFCD00719450
IUPAC Name:
2-amino-4-methylsulfonylphenol
InChI:
InChI=1S/C7H9NO3S/c1-12(10,11)5-2-3-7(9)6(8)4-5/h2-4,9H,8H2,1H3
InChI Key:
SFLMBHYNCSYPOO-UHFFFAOYSA-N
SMILES:
Oc1ccc(cc1N)S(=O)(=O)C
EC Number:
202-654-4

Properties

Complexity:
244  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
187.03g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
187.213g/mol
Monoisotopic Mass:
187.03g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
88.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4  

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