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115665-52-6 | Glycine, N-methyl-N-(methylsulfonyl)-
CAS No: 115665-52-6 Catalog No: AG000GPP MDL No:MFCD07403636
Product Description
Catalog Number:
AG000GPP
Chemical Name:
Glycine, N-methyl-N-(methylsulfonyl)-
CAS Number:
115665-52-6
Molecular Formula:
C4H9NO4S
Molecular Weight:
167.1836
MDL Number:
MFCD07403636
IUPAC Name:
2-[methyl(methylsulfonyl)amino]acetic acid
InChI:
InChI=1S/C4H9NO4S/c1-5(3-4(6)7)10(2,8)9/h3H2,1-2H3,(H,6,7)
InChI Key:
BJJBJDSBYILUDE-UHFFFAOYSA-N
SMILES:
OC(=O)CN(S(=O)(=O)C)C
Properties
Complexity:
214
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
167.025g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
167.179g/mol
Monoisotopic Mass:
167.025g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
83.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.9
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