tert-Butyl (2-((4-Aminophenyl)amino)-2-oxoethyl)carbamate - CAS 83209-85-2
Catalog: |
BB055456 |
Product Name: |
tert-Butyl (2-((4-Aminophenyl)amino)-2-oxoethyl)carbamate |
CAS: |
83209-85-2 |
Synonyms: |
Tert-butyl N-[2-(4-aminoanilino)-2-oxoethyl]carbamate; tert-Butyl (2-((4-aminophenyl)amino)-2-oxoethyl)carbamate |
IUPAC Name: | tert-butyl N-[2-(4-aminoanilino)-2-oxoethyl]carbamate |
Molecular Weight: | 265.31 |
Molecular Formula: | C13H19N3O3 |
Canonical SMILES: | CC(C)(C)OC(=O)NCC(=O)NC1=CC=C(C=C1)N |
InChI: | InChI=1S/C13H19N3O3/c1-13(2,3)19-12(18)15-8-11(17)16-10-6-4-9(14)5-7-10/h4-7H,8,14H2,1-3H3,(H,15,18)(H,16,17) |
InChI Key: | BFAIQOGCCIZPAN-UHFFFAOYSA-N |
Complexity: | 318 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 265.14264148 |
Formal Charge: | 0 |
Heavy Atom Count: | 19 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 3 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 265.14264148 |
Rotatable Bond Count: | 5 |
Topological Polar Surface Area: | 93.4Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.2 |
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