N,N-bisBoc 2-Chlorosulfonylethylamine - CAS 1380171-04-9
Catalog: |
BB073205 |
Product Name: |
N,N-bisBoc 2-Chlorosulfonylethylamine |
CAS: |
1380171-04-9 |
Synonyms: |
N,N-bisBoc 2-Chlorosulfonylethylamine; tert-butyl N-(2-chlorosulfonylethyl)-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate; tert-butyl N-[(tert-butoxy)carbonyl]-N-[2-(chlorosulfonyl)ethyl]carbamate |
IUPAC Name: | tert-butyl N-(2-chlorosulfonylethyl)-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamate |
Molecular Weight: | 343.82 |
Molecular Formula: | C12H22ClNO6S |
Canonical SMILES: | CC(C)(C)OC(=O)N(CCS(=O)(=O)Cl)C(=O)OC(C)(C)C |
InChI: | InChI=1S/C12H22ClNO6S/c1-11(2,3)19-9(15)14(7-8-21(13,17)18)10(16)20-12(4,5)6/h7-8H2,1-6H3 |
InChI Key: | GJKHVHIDCQEYHI-UHFFFAOYSA-N |
Complexity: | 455 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 343.0856363 |
Formal Charge: | 0 |
Heavy Atom Count: | 21 |
Hydrogen Bond Acceptor Count: | 6 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 343.0856363 |
Rotatable Bond Count: | 7 |
Topological Polar Surface Area: | 98.4Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.4 |
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