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119342-48-2 | Glycine, N-[(dimethylamino)thioxomethyl]-N-methyl-
CAS No: 119342-48-2 Catalog No: AG000IN1 MDL No:
Product Description
Catalog Number:
AG000IN1
Chemical Name:
Glycine, N-[(dimethylamino)thioxomethyl]-N-methyl-
CAS Number:
119342-48-2
Molecular Formula:
C6H12N2O2S
Molecular Weight:
176.2367
IUPAC Name:
2-[dimethylcarbamothioyl(methyl)amino]acetic acid
InChI:
InChI=1S/C6H12N2O2S/c1-7(2)6(11)8(3)4-5(9)10/h4H2,1-3H3,(H,9,10)
InChI Key:
VIBPNYGNMMRDQG-UHFFFAOYSA-N
SMILES:
CN(C(=S)N(C)C)CC(=O)O
Properties
Complexity:
170
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
176.062g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
176.234g/mol
Monoisotopic Mass:
176.062g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
75.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.1
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