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78397-39-4 | (S)-Methyl 5-amino-2-((tert-butoxycarbonyl)amino)pentanoate
CAS No: 78397-39-4 Catalog No: AG0053JY MDL No:MFCD23135267
Product Description
Catalog Number:
AG0053JY
Chemical Name:
(S)-Methyl 5-amino-2-((tert-butoxycarbonyl)amino)pentanoate
CAS Number:
78397-39-4
Molecular Formula:
C11H22N2O4
Molecular Weight:
246.3034
MDL Number:
MFCD23135267
IUPAC Name:
methyl (2S)-5-amino-2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoate
InChI:
InChI=1S/C11H22N2O4/c1-11(2,3)17-10(15)13-8(6-5-7-12)9(14)16-4/h8H,5-7,12H2,1-4H3,(H,13,15)/t8-/m0/s1
InChI Key:
DOKURIHNVIXJHI-QMMMGPOBSA-N
SMILES:
NCCC[C@@H](C(=O)OC)NC(=O)OC(C)(C)C
Properties
Complexity:
261
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
246.158g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
246.307g/mol
Monoisotopic Mass:
246.158g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
90.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2
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