147622-09-1,MFCD00548049
Catalog No.:AA001EZ3

147622-09-1 | Benzene, 1-[(2,2-dichloro-1-isothiocyanatoethenyl)sulfonyl]-4-methyl-

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  • Properties
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Technical Information
Catalog Number:
AA001EZ3
Chemical Name:
Benzene, 1-[(2,2-dichloro-1-isothiocyanatoethenyl)sulfonyl]-4-methyl-
CAS Number:
147622-09-1
Molecular Formula:
C10H7Cl2NO2S2
Molecular Weight:
308.2041
MDL Number:
MFCD00548049
SMILES:
S=C=NC(=C(Cl)Cl)S(=O)(=O)c1ccc(cc1)C
Properties
Computed Properties
 
Complexity:
449  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0  
Isotope Atom Count:
0  
Rotatable Bond Count:
3  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
4.7  

Literature
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SDS
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Tags:147622-09-1 Molecular Formula|147622-09-1 MDL|147622-09-1 SMILES|147622-09-1 Benzene, 1-[(2,2-dichloro-1-isothiocyanatoethenyl)sulfonyl]-4-methyl-
Catalog No.: AA001EZ3
147622-09-1,MFCD00548049
147622-09-1 | Benzene, 1-[(2,2-dichloro-1-isothiocyanatoethenyl)sulfonyl]-4-methyl-
This product is typically in stock,please click "Inquire" below or contact us at [email protected]for pricing and availability information.
Inquire
Technical Information
Catalog Number: AA001EZ3
Chemical Name: Benzene, 1-[(2,2-dichloro-1-isothiocyanatoethenyl)sulfonyl]-4-methyl-
CAS Number: 147622-09-1
Molecular Formula: C10H7Cl2NO2S2
Molecular Weight: 308.2041
MDL Number: MFCD00548049
SMILES: S=C=NC(=C(Cl)Cl)S(=O)(=O)c1ccc(cc1)C
Properties
Complexity: 449  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 17  
Hydrogen Bond Acceptor Count: 4  
Hydrogen Bond Donor Count: 0  
Isotope Atom Count: 0  
Rotatable Bond Count: 3  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 4.7  
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