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190773-04-7

190773-04-7 | Leucine, N-[[(3,5-dinitrophenyl)methoxy]carbonyl]-

CAS No: 190773-04-7 Catalog No: AG002ESP MDL No:

Product Description

Catalog Number:
AG002ESP
Chemical Name:
Leucine, N-[[(3,5-dinitrophenyl)methoxy]carbonyl]-
CAS Number:
190773-04-7
Molecular Formula:
C14H17N3O8
Molecular Weight:
355.3001
IUPAC Name:
(2S)-2-[(3,5-dinitrophenyl)methoxycarbonylamino]-4-methylpentanoic acid
InChI:
InChI=1S/C14H17N3O8/c1-8(2)3-12(13(18)19)15-14(20)25-7-9-4-10(16(21)22)6-11(5-9)17(23)24/h4-6,8,12H,3,7H2,1-2H3,(H,15,20)(H,18,19)/t12-/m0/s1
InChI Key:
BYEZSYMZYFZIBA-LBPRGKRZSA-N
SMILES:
CC(C[C@@H](C(=O)O)NC(=O)OCc1cc(cc(c1)[N+](=O)[O-])[N+](=O)[O-])C

Properties

Complexity:
491  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
355.102g/mol
Formal Charge:
0
Heavy Atom Count:
25  
Hydrogen Bond Acceptor Count:
8  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
355.303g/mol
Monoisotopic Mass:
355.102g/mol
Rotatable Bond Count:
7  
Topological Polar Surface Area:
167A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  

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