Boc- R- 3- amino- 3- phenylpropanal - CAS 212560-65-1
Catalog: |
BB072493 |
Product Name: |
Boc- R- 3- amino- 3- phenylpropanal |
CAS: |
212560-65-1 |
Synonyms: |
Boc-(R)-3-Amino-3-phenylpropanal; Boc-R-3-amino-3-phenylpropanal; TERT-BUTYL N-[(1R)-3-OXO-1-PHENYLPROPYL]CARBAMATE |
IUPAC Name: | tert-butyl N-[(1R)-3-oxo-1-phenylpropyl]carbamate |
Molecular Weight: | 249.31 |
Molecular Formula: | C14H19NO3 |
Canonical SMILES: | CC(C)(C)OC(=O)NC(CC=O)C1=CC=CC=C1 |
InChI: | InChI=1S/C14H19NO3/c1-14(2,3)18-13(17)15-12(9-10-16)11-7-5-4-6-8-11/h4-8,10,12H,9H2,1-3H3,(H,15,17)/t12-/m1/s1 |
InChI Key: | ZGPCDZZHEWGTEU-GFCCVEGCSA-N |
Complexity: | 277 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 1 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 249.13649347 |
Formal Charge: | 0 |
Heavy Atom Count: | 18 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 249.13649347 |
Rotatable Bond Count: | 6 |
Topological Polar Surface Area: | 55.4Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.9 |
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