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Home > Nitro Compounds > 204438-82-4
204438-82-4 | L-Leucine, 4-(nitrosothio)-
CAS No: 204438-82-4 Catalog No: AG0029I6 MDL No:
Product Description
Catalog Number:
AG0029I6
Chemical Name:
L-Leucine, 4-(nitrosothio)-
CAS Number:
204438-82-4
Molecular Formula:
C6H12N2O3S
Molecular Weight:
192.2361
IUPAC Name:
(2S)-2-amino-4-methyl-4-nitrososulfanylpentanoic acid
InChI:
InChI=1S/C6H12N2O3S/c1-6(2,12-8-11)3-4(7)5(9)10/h4H,3,7H2,1-2H3,(H,9,10)/t4-/m0/s1
InChI Key:
NZHNKHKBTLEVTJ-BYPYZUCNSA-N
SMILES:
O=NSC(C[C@@H](C(=O)O)N)(C)C
Properties
Complexity:
184
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
192.057g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
192.233g/mol
Monoisotopic Mass:
192.057g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
118A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-2.4
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