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Home Sulfos (2,4-Dimethylphenyl)(isocyano)methyl 4-methylphenyl sulfone

(2,4-Dimethylphenyl)(isocyano)methyl 4-methylphenyl sulfone

CAS No.:
1247878-30-3
Catalog Number:
AG009VO5
Molecular Formula:
C17H17NO2S
Molecular Weight:
299.3874
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
98%
In Stock USA
United States
$225
- +
1g
98%
In Stock USA
United States
$563
- +
5g
98%
In Stock USA
United States
$2000
- +
Product Description
Catalog Number:
AG009VO5
Chemical Name:
(2,4-Dimethylphenyl)(isocyano)methyl 4-methylphenyl sulfone
CAS Number:
1247878-30-3
Molecular Formula:
C17H17NO2S
Molecular Weight:
299.3874
MDL Number:
MFCD07390284
IUPAC Name:
1-[isocyano-(4-methylphenyl)sulfonylmethyl]-2,4-dimethylbenzene
InChI:
InChI=1S/C17H17NO2S/c1-12-5-8-15(9-6-12)21(19,20)17(18-4)16-10-7-13(2)11-14(16)3/h5-11,17H,1-3H3
InChI Key:
GGEVCMLDVLELSH-UHFFFAOYSA-N
SMILES:
[C-]#[N+]C(S(=O)(=O)c1ccc(cc1)C)c1ccc(cc1C)C
Properties
Complexity:
491  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
299.098g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
299.388g/mol
Monoisotopic Mass:
299.098g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
46.9A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7  
Properties