Home Other Building Blocks 1-cyclopropyl-1,3-dihydro-2lambda6,1,3-benzothiadiazole-2,2-dione

1-cyclopropyl-1,3-dihydro-2lambda6,1,3-benzothiadiazole-2,2-dione

CAS No.:
2044713-76-8
Catalog Number:
AG01BVJW
Molecular Formula:
C9H10N2O2S
Molecular Weight:
210.2529
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Product Description
Catalog Number:
AG01BVJW
Chemical Name:
1-cyclopropyl-1,3-dihydro-2lambda6,1,3-benzothiadiazole-2,2-dione
CAS Number:
2044713-76-8
Molecular Formula:
C9H10N2O2S
Molecular Weight:
210.2529
MDL Number:
MFCD30476447
IUPAC Name:
3-cyclopropyl-1H-2λ6,1,3-benzothiadiazole 2,2-dioxide
InChI:
InChI=1S/C9H10N2O2S/c12-14(13)10-8-3-1-2-4-9(8)11(14)7-5-6-7/h1-4,7,10H,5-6H2
InChI Key:
CFAIHEBXDMMBRA-UHFFFAOYSA-N
SMILES:
O=S1(=O)Nc2c(N1C1CC1)cccc2
Properties
Complexity:
331  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
210.046g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
210.251g/mol
Monoisotopic Mass:
210.046g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
57.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1  
Properties