Home Sulfos BenzenaMine, 3-Methyl-4-(Methylsulfonyl)-

BenzenaMine, 3-Methyl-4-(Methylsulfonyl)-

CAS No.:
1671-50-7
Catalog Number:
AG001X4R
Molecular Formula:
C8H11NO2S
Molecular Weight:
185.2434
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG001X4R
Chemical Name:
BenzenaMine, 3-Methyl-4-(Methylsulfonyl)-
CAS Number:
1671-50-7
Molecular Formula:
C8H11NO2S
Molecular Weight:
185.2434
MDL Number:
MFCD01463514
IUPAC Name:
3-methyl-4-methylsulfonylaniline
InChI:
InChI=1S/C8H11NO2S/c1-6-5-7(9)3-4-8(6)12(2,10)11/h3-5H,9H2,1-2H3
InChI Key:
XJSGKXZRGAIREF-UHFFFAOYSA-N
SMILES:
Nc1ccc(c(c1)C)S(=O)(=O)C
Properties
Complexity:
242  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
185.051g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
185.241g/mol
Monoisotopic Mass:
185.051g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
68.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3  
Literature
Title Journal
Microsphere-based protease assays and screening application for lethal factor and factor Xa. Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501
Properties