Home Carbonyls Alanine, N-[(1,1-dimethylethoxy)carbonyl]-3,3,3-trifluoro-

Alanine, N-[(1,1-dimethylethoxy)carbonyl]-3,3,3-trifluoro-

CAS No.:
188030-43-5
Catalog Number:
AG002GO4
Molecular Formula:
C8H12F3NO4
Molecular Weight:
243.1804
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
95%
1 week
United States
$514
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Product Description
Catalog Number:
AG002GO4
Chemical Name:
Alanine, N-[(1,1-dimethylethoxy)carbonyl]-3,3,3-trifluoro-
CAS Number:
188030-43-5
Molecular Formula:
C8H12F3NO4
Molecular Weight:
243.1804
MDL Number:
MFCD10697680
IUPAC Name:
3,3,3-trifluoro-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid
InChI:
InChI=1S/C8H12F3NO4/c1-7(2,3)16-6(15)12-4(5(13)14)8(9,10)11/h4H,1-3H3,(H,12,15)(H,13,14)
InChI Key:
DRKWWMGEXDHBSK-UHFFFAOYSA-N
SMILES:
O=C(OC(C)(C)C)N[C@@H](C(F)(F)F)C(=O)O
Properties
Complexity:
282  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
243.072g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
243.182g/mol
Monoisotopic Mass:
243.072g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
75.6A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Properties