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23506-52-7 | Glycine, N-acetyl-L-alanyl-
CAS No: 23506-52-7 Catalog No: AG002NG5 MDL No:
Product Description
Catalog Number:
AG002NG5
Chemical Name:
Glycine, N-acetyl-L-alanyl-
CAS Number:
23506-52-7
Molecular Formula:
C7H12N2O4
Molecular Weight:
188.1812
IUPAC Name:
2-[[(2S)-2-acetamidopropanoyl]amino]acetic acid
InChI:
InChI=1S/C7H12N2O4/c1-4(9-5(2)10)7(13)8-3-6(11)12/h4H,3H2,1-2H3,(H,8,13)(H,9,10)(H,11,12)/t4-/m0/s1
InChI Key:
OJEZODIGGOJWJW-BYPYZUCNSA-N
SMILES:
OC(=O)CNC(=O)[C@@H](NC(=O)C)C
Properties
Complexity:
227
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
188.08g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
188.183g/mol
Monoisotopic Mass:
188.08g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
95.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.1
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