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150403-97-7 | L-Ornithine, N5-(1-iminobutyl)-, monohydrochloride (9CI)
CAS No: 150403-97-7 Catalog No: AG001MLE MDL No:MFCD11113147
Product Description
Catalog Number:
AG001MLE
Chemical Name:
L-Ornithine, N5-(1-iminobutyl)-, monohydrochloride (9CI)
CAS Number:
150403-97-7
Molecular Formula:
C9H20ClN3O2
Molecular Weight:
237.7270
MDL Number:
MFCD11113147
IUPAC Name:
chloro (2S)-2-amino-5-(1-aminobutylideneamino)pentanoate
InChI:
InChI=1S/C9H18ClN3O2/c1-2-4-8(12)13-6-3-5-7(11)9(14)15-10/h7H,2-6,11H2,1H3,(H2,12,13)/t7-/m0/s1
InChI Key:
HICULVOPJMRQHX-ZETCQYMHSA-N
SMILES:
CCCC(=N)NCCC[C@@H](C(=O)O)N.Cl
Properties
Complexity:
221
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
235.109g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
235.712g/mol
Monoisotopic Mass:
235.109g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
90.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
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