Home Aminos 3-[(3,4-dimethylphenyl)amino]-2,3-dihydro-1$l^{6}-thiophene-1,1-dione

3-[(3,4-dimethylphenyl)amino]-2,3-dihydro-1$l^{6}-thiophene-1,1-dione

CAS No.:
301229-94-7
Catalog Number:
AG00VS3G
Molecular Formula:
C12H15NO2S
Molecular Weight:
237.3180
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Product Description
Catalog Number:
AG00VS3G
Chemical Name:
3-[(3,4-dimethylphenyl)amino]-2,3-dihydro-1$l^{6}-thiophene-1,1-dione
CAS Number:
301229-94-7
Molecular Formula:
C12H15NO2S
Molecular Weight:
237.3180
MDL Number:
MFCD01123444
IUPAC Name:
N-(3,4-dimethylphenyl)-1,1-dioxo-2,3-dihydrothiophen-3-amine
InChI:
InChI=1S/C12H15NO2S/c1-9-3-4-11(7-10(9)2)13-12-5-6-16(14,15)8-12/h3-7,12-13H,8H2,1-2H3
InChI Key:
HJXYTODHBGFIKK-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1C)NC1C=CS(=O)(=O)C1
Properties
Complexity:
369  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
237.082g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
237.317g/mol
Monoisotopic Mass:
237.082g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
54.6A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2  
Properties