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Home > Fluorides > 288266-54-6
288266-54-6 | L-Alanine, N-[[3-(trifluoromethyl)phenyl]sulfonyl]-
CAS No: 288266-54-6 Catalog No: AG002WOJ MDL No:MFCD04972340
Product Description
Catalog Number:
AG002WOJ
Chemical Name:
L-Alanine, N-[[3-(trifluoromethyl)phenyl]sulfonyl]-
CAS Number:
288266-54-6
Molecular Formula:
C10H10F3NO4S
Molecular Weight:
297.2509
MDL Number:
MFCD04972340
IUPAC Name:
2-[[3-(trifluoromethyl)phenyl]sulfonylamino]propanoic acid
InChI:
InChI=1S/C10H10F3NO4S/c1-6(9(15)16)14-19(17,18)8-4-2-3-7(5-8)10(11,12)13/h2-6,14H,1H3,(H,15,16)
InChI Key:
OZVPEEXYQQFKJL-UHFFFAOYSA-N
SMILES:
OC(=O)[C@@H](NS(=O)(=O)c1cccc(c1)C(F)(F)F)C
Properties
Complexity:
429
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
297.028g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
8
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
297.248g/mol
Monoisotopic Mass:
297.028g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
91.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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