sales@angenesci.com
Login | Register
logo
Structures Search
Home Other Building Blocks L-Phenylalanine, 1,1-dimethylethyl ester

L-Phenylalanine, 1,1-dimethylethyl ester

CAS No.:
16874-17-2
Catalog Number:
AG001Y9T
Molecular Formula:
C13H19NO2
Molecular Weight:
221.2955
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG001Y9T
Chemical Name:
L-Phenylalanine, 1,1-dimethylethyl ester
CAS Number:
16874-17-2
Molecular Formula:
C13H19NO2
Molecular Weight:
221.2955
MDL Number:
MFCD00038270
IUPAC Name:
tert-butyl (2S)-2-amino-3-phenylpropanoate
InChI:
InChI=1S/C13H19NO2/c1-13(2,3)16-12(15)11(14)9-10-7-5-4-6-8-10/h4-8,11H,9,14H2,1-3H3/t11-/m0/s1
InChI Key:
QOISWWBTZMFUEL-NSHDSACASA-N
SMILES:
N[C@H](C(=O)OC(C)(C)C)Cc1ccccc1
Properties
Complexity:
227  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
221.142g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
221.3g/mol
Monoisotopic Mass:
221.142g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
52.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  
Literature
Title Journal
Discovery and Structure-Activity Relationships of the Neoseptins: A New Class of Toll-like Receptor-4 (TLR4) Agonists. Journal of medicinal chemistry 20160526
Synthetic studies on (-)-lemonomycin: an efficient asymmetric synthesis of lemonomycinone amide. The Journal of organic chemistry 20090306
Conformational rearrangements by water-soluble peptoid foldamers. Organic letters 20071122
Properties