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156719-37-8

156719-37-8 | L-Ornithine, N5-(aminothioxomethyl)-

CAS No: 156719-37-8 Catalog No: AG001OX6 MDL No:MFCD00935993

Product Description

Catalog Number:
AG001OX6
Chemical Name:
L-Ornithine, N5-(aminothioxomethyl)-
CAS Number:
156719-37-8
Molecular Formula:
C6H13N3O2S
Molecular Weight:
191.2513
MDL Number:
MFCD00935993
IUPAC Name:
(2S)-2-amino-5-(carbamoylamino)pentanethioic S-acid
InChI:
InChI=1S/C6H13N3O2S/c7-4(5(10)12)2-1-3-9-6(8)11/h4H,1-3,7H2,(H,10,12)(H3,8,9,11)/t4-/m0/s1
InChI Key:
VFTIJOHMEIZFTN-BYPYZUCNSA-N
SMILES:
NC(=S)NCCC[C@@H](C(=O)O)N

Properties

Complexity:
174  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
191.073g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
4  
Isotope Atom Count:
0
Molecular Weight:
191.249g/mol
Monoisotopic Mass:
191.073g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
99.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.5  

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