1-Boc-2-(4-nitrobenzenesulfonyl)hydrazine - CAS 333440-71-4
Catalog: |
BB021679 |
Product Name: |
1-Boc-2-(4-nitrobenzenesulfonyl)hydrazine |
CAS: |
333440-71-4 |
Synonyms: |
tert-butyl N-[(4-nitrophenyl)sulfonylamino]carbamate |
IUPAC Name: | tert-butyl N-[(4-nitrophenyl)sulfonylamino]carbamate |
Description: | 1-Boc-2-(4-nitrobenzenesulfonyl)hydrazine (CAS# 333440-71-4 ) is a useful research chemical. |
Molecular Weight: | 317.32 |
Molecular Formula: | C11H15N3O6S |
Canonical SMILES: | CC(C)(C)OC(=O)NNS(=O)(=O)C1=CC=C(C=C1)[N+](=O)[O-] |
InChI: | InChI=1S/C11H15N3O6S/c1-11(2,3)20-10(15)12-13-21(18,19)9-6-4-8(5-7-9)14(16)17/h4-7,13H,1-3H3,(H,12,15) |
InChI Key: | NOJCYFMYHGQHAM-UHFFFAOYSA-N |
MDL: | MFCD01985162 |
LogP: | 3.51210 |
GHS Hazard Statement: | H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P272, P280, P301+P310, P302+P352, P321, P330, P333+P313, P363, P405, and P501 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
US-2006019959-A1 | Novel quinoxalinone derivatives | 20021029 |
US-2009137597-A1 | Novel quinoxalinone derivatives | 20021029 |
US-7388010-B2 | Quinoxalinone derivatives | 20021029 |
Complexity: | 480 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 317.06815638 |
Formal Charge: | 0 |
Heavy Atom Count: | 21 |
Hydrogen Bond Acceptor Count: | 7 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 317.06815638 |
Rotatable Bond Count: | 5 |
Topological Polar Surface Area: | 139 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.6 |
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