N-tert-Butoxycarbonyl 2-[(3-Methyl-1-oxo)butyl]aniline Oxime - CAS 1246834-00-3
Catalog: |
BB071825 |
Product Name: |
N-tert-Butoxycarbonyl 2-[(3-Methyl-1-oxo)butyl]aniline Oxime |
CAS: |
1246834-00-3 |
Synonyms: |
N-tert-Butoxycarbonyl 2-[(3-Methyl-1-oxo)butyl]aniline Oxime; tert-butyl N-[2-[(Z)-N-hydroxy-C-(2-methylpropyl)carbonimidoyl]phenyl]carbamate |
IUPAC Name: | tert-butyl N-[2-[(Z)-N-hydroxy-C-(2-methylpropyl)carbonimidoyl]phenyl]carbamate |
Description: | N-tert-Butoxycarbonyl 2-[(3-Methyl-1-oxo)butyl]aniline Oxime (cas# 1246834-00-3) is a compound useful in organic synthesis. |
Molecular Weight: | 292.37 |
Molecular Formula: | C16H24N2O3 |
Canonical SMILES: | CC(C)CC(=NO)C1=CC=CC=C1NC(=O)OC(C)(C)C |
InChI: | InChI=1S/C16H24N2O3/c1-11(2)10-14(18-20)12-8-6-7-9-13(12)17-15(19)21-16(3,4)5/h6-9,11,20H,10H2,1-5H3,(H,17,19)/b18-14- |
InChI Key: | AKZYIZTWBFHYFZ-JXAWBTAJSA-N |
Complexity: | 372 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 1 |
Exact Mass: | 292.17869263 |
Formal Charge: | 0 |
Heavy Atom Count: | 21 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 292.17869263 |
Rotatable Bond Count: | 6 |
Topological Polar Surface Area: | 70.9Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.7 |
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