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27506-15-6 | L-Leucine, N-[(1,1-dimethylethoxy)carbonyl]-L-valyl-
CAS No: 27506-15-6 Catalog No: AG002TZ0 MDL No:
Product Description
Catalog Number:
AG002TZ0
Chemical Name:
L-Leucine, N-[(1,1-dimethylethoxy)carbonyl]-L-valyl-
CAS Number:
27506-15-6
Molecular Formula:
C16H30N2O5
Molecular Weight:
330.4198
IUPAC Name:
(2S)-4-methyl-2-[[(2S)-3-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoyl]amino]pentanoic acid
InChI:
InChI=1S/C16H30N2O5/c1-9(2)8-11(14(20)21)17-13(19)12(10(3)4)18-15(22)23-16(5,6)7/h9-12H,8H2,1-7H3,(H,17,19)(H,18,22)(H,20,21)/t11-,12-/m0/s1
InChI Key:
PUUABEGDHGDROR-RYUDHWBXSA-N
SMILES:
CC(C[C@@H](C(=O)O)NC(=O)[C@H](C(C)C)NC(=O)OC(C)(C)C)C
Properties
Complexity:
427
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Exact Mass:
330.215g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
330.425g/mol
Monoisotopic Mass:
330.215g/mol
Rotatable Bond Count:
9
Topological Polar Surface Area:
105A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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