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Home Other Building Blocks Ac-phe-nh2

Ac-phe-nh2

CAS No.:
7376-90-1
Catalog Number:
AG00FAZ5
Molecular Formula:
C11H14N2O2
Molecular Weight:
206.2411
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
≥ 99% (TLC)
1 week
United States
$104
- +
5g
≥ 99% (TLC)
1 week
United States
$345
- +
25g
≥ 99% (TLC)
1 week
United States
$1493
- +
Product Description
Catalog Number:
AG00FAZ5
Chemical Name:
Ac-phe-nh2
CAS Number:
7376-90-1
Molecular Formula:
C11H14N2O2
Molecular Weight:
206.2411
MDL Number:
MFCD00080840
IUPAC Name:
(2S)-2-acetamido-3-phenylpropanamide
InChI:
InChI=1S/C11H14N2O2/c1-8(14)13-10(11(12)15)7-9-5-3-2-4-6-9/h2-6,10H,7H2,1H3,(H2,12,15)(H,13,14)/t10-/m0/s1
InChI Key:
LRSBEAVFLIKKIO-JTQLQIEISA-N
SMILES:
NC(=O)[C@H](Cc1ccccc1)NC(=O)C C11H14N2O2
Properties
Complexity:
235  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
206.106g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
206.245g/mol
Monoisotopic Mass:
206.106g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
72.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0
Literature
Title Journal
Signature of the conformational preferences of small peptides: a theoretical investigation. The journal of physical chemistry. A 20070906
The gas-phase dipeptide analogue acetyl-phenylalanyl-amide: a model for the study of side chain/backbone interactions in proteins. The journal of physical chemistry. A 20050623
Characterization of the conformational probability of N-acetyl-phenylalanyl-NH2 by RHF, DFT, and MP2 computation and AIM analyses, confirmed by jet-cooled infrared data. The journal of physical chemistry. A 20050623
Properties