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147290-10-6 | L-Ornithine, N5-[(2-propen-1-yloxy)carbonyl]-
CAS No: 147290-10-6 Catalog No: AG001ERR MDL No:
Product Description
Catalog Number:
AG001ERR
Chemical Name:
L-Ornithine, N5-[(2-propen-1-yloxy)carbonyl]-
CAS Number:
147290-10-6
Molecular Formula:
C9H16N2O4
Molecular Weight:
216.2343
IUPAC Name:
(2S)-2-amino-5-(prop-2-enoxycarbonylamino)pentanoic acid
InChI:
InChI=1S/C9H16N2O4/c1-2-6-15-9(14)11-5-3-4-7(10)8(12)13/h2,7H,1,3-6,10H2,(H,11,14)(H,12,13)/t7-/m0/s1
InChI Key:
PIBIUFMNGVYLNI-ZETCQYMHSA-N
SMILES:
N[C@H](C(=O)O)CCCNC(=O)OCC=C
Properties
Complexity:
230
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
216.111g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
216.237g/mol
Monoisotopic Mass:
216.111g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
102A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-2.3
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