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124278-35-9 | L-Phenylalanine, N-[(dimethylamino)sulfonyl]-
CAS No: 124278-35-9 Catalog No: AG000LS6 MDL No:MFCD16377815
Product Description
Catalog Number:
AG000LS6
Chemical Name:
L-Phenylalanine, N-[(dimethylamino)sulfonyl]-
CAS Number:
124278-35-9
Molecular Formula:
C11H16N2O4S
Molecular Weight:
272.3207
MDL Number:
MFCD16377815
IUPAC Name:
(2S)-2-(dimethylsulfamoylamino)-3-phenylpropanoic acid
InChI:
InChI=1S/C11H16N2O4S/c1-13(2)18(16,17)12-10(11(14)15)8-9-6-4-3-5-7-9/h3-7,10,12H,8H2,1-2H3,(H,14,15)/t10-/m0/s1
InChI Key:
IACLODAEXRIAEF-JTQLQIEISA-N
SMILES:
CN(S(=O)(=O)N[C@H](C(=O)O)Cc1ccccc1)C
Properties
Complexity:
369
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
272.083g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
272.319g/mol
Monoisotopic Mass:
272.083g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
95.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
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