1-({[(Benzyloxy)carbonyl]amino}amino)-2,2,2-trifluoroethanone - CAS 866478-74-2
Catalog: |
BB055397 |
Product Name: |
1-({[(Benzyloxy)carbonyl]amino}amino)-2,2,2-trifluoroethanone |
CAS: |
866478-74-2 |
Synonyms: |
Benzyl 2-(2,2,2-trifluoroacetyl)hydrazinecarboxylate; 1-({[(BENZYLOXY)CARBONYL]AMINO}AMINO)-2,2,2-TRIFLUOROETHANONE; benzyl N-[(2,2,2-trifluoroacetyl)amino]carbamate; benzyl 2-(trifluoroacetyl)hydrazinecarboxylate; Benzyl2-(2,2,2-trifluoroacetyl)hydrazinecarboxylate |
IUPAC Name: | benzyl N-[(2,2,2-trifluoroacetyl)amino]carbamate |
Description: | 1-({[(Benzyloxy)carbonyl]amino}amino)-2,2,2-trifluoroethanone |
Molecular Weight: | 262.19 |
Molecular Formula: | C10H9F3N2O3 |
Canonical SMILES: | C1=CC=C(C=C1)COC(=O)NNC(=O)C(F)(F)F |
InChI: | InChI=1S/C10H9F3N2O3/c11-10(12,13)8(16)14-15-9(17)18-6-7-4-2-1-3-5-7/h1-5H,6H2,(H,14,16)(H,15,17) |
InChI Key: | ORLORBVOVFSZJZ-UHFFFAOYSA-N |
Complexity: | 301 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 262.05652664 |
Formal Charge: | 0 |
Heavy Atom Count: | 18 |
Hydrogen Bond Acceptor Count: | 6 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 262.05652664 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 67.4Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.1 |
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