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Also known as: 630421-42-0, N-(tert-butyl)cyclopropanesulfonamide, Cyclopropanesulfonic acid tert-butylamide, Schembl832867, Dtxsid00626264, N-(t-butyl)cyclopropanesulfonamide
Molecular Formula
C7H15NO2S
Molecular Weight
177.27  g/mol
InChI Key
JTZIZFSBVOHJQD-UHFFFAOYSA-N

CAS 630421-42-0
1 2D Structure

CAS 630421-42-0

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
N-tert-butylcyclopropanesulfonamide
2.1.2 InChI
InChI=1S/C7H15NO2S/c1-7(2,3)8-11(9,10)6-4-5-6/h6,8H,4-5H2,1-3H3
2.1.3 InChI Key
JTZIZFSBVOHJQD-UHFFFAOYSA-N
2.1.4 Canonical SMILES
CC(C)(C)NS(=O)(=O)C1CC1
2.2 Synonyms
2.2.1 Depositor-Supplied Synonyms

1. 630421-42-0

2. N-(tert-butyl)cyclopropanesulfonamide

3. Cyclopropanesulfonic Acid Tert-butylamide

4. Schembl832867

5. Dtxsid00626264

6. N-(t-butyl)cyclopropanesulfonamide

7. N-t-butyl-1-cyclopropylsulfonamide

8. N-tert-butyl Cyclopropylsulfonamide

9. Mfcd11505907

10. Zinc44137829

11. Akos006325033

12. Ac-30861

13. As-37150

14. Cs-0154867

15. A847188

16. A1-08879

17. Cyclopropanesulfonic Acid Tert-butylamide;n-tert-butylcyclopropanesulfonamide

2.3 Create Date
2007-12-05
3 Chemical and Physical Properties
Molecular Weight 177.27 g/mol
Molecular Formula C7H15NO2S
XLogP30.9
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count3
Exact Mass177.08234989 g/mol
Monoisotopic Mass177.08234989 g/mol
Topological Polar Surface Area54.6 Ų
Heavy Atom Count11
Formal Charge0
Complexity228
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1

BUILDING BLOCK

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