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16305-80-9 | Glycine, N-[(2S)-2-amino-1-oxobutyl]-
CAS No: 16305-80-9 Catalog No: AG001TNE MDL No:MFCD00237696
Product Description
Catalog Number:
AG001TNE
Chemical Name:
Glycine, N-[(2S)-2-amino-1-oxobutyl]-
CAS Number:
16305-80-9
Molecular Formula:
C6H12N2O3
Molecular Weight:
160.1711
MDL Number:
MFCD00237696
IUPAC Name:
2-[[(2S)-2-aminobutanoyl]amino]acetic acid
InChI:
InChI=1S/C6H12N2O3/c1-2-4(7)6(11)8-3-5(9)10/h4H,2-3,7H2,1H3,(H,8,11)(H,9,10)/t4-/m0/s1
InChI Key:
SVHUWZOIWWJJJM-BYPYZUCNSA-N
SMILES:
CC[C@@H](C(=O)NCC(=O)O)N
Properties
Complexity:
158
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
160.085g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
160.173g/mol
Monoisotopic Mass:
160.085g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
92.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-3.1
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