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130878-68-1 | L-Valine, N-[(9H-fluoren-9-ylmethoxy)carbonyl]-, 2,5-dioxo-1-pyrrolidinyl ester
CAS No: 130878-68-1 Catalog No: AG000V25 MDL No:MFCD00153370
Product Description
Catalog Number:
AG000V25
Chemical Name:
L-Valine, N-[(9H-fluoren-9-ylmethoxy)carbonyl]-, 2,5-dioxo-1-pyrrolidinyl ester
CAS Number:
130878-68-1
Molecular Formula:
C24H24N2O6
Molecular Weight:
436.4572
MDL Number:
MFCD00153370
IUPAC Name:
(2,5-dioxopyrrolidin-1-yl) (2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-methylbutanoate
InChI:
InChI=1S/C24H24N2O6/c1-14(2)22(23(29)32-26-20(27)11-12-21(26)28)25-24(30)31-13-19-17-9-5-3-7-15(17)16-8-4-6-10-18(16)19/h3-10,14,19,22H,11-13H2,1-2H3,(H,25,30)/t22-/m0/s1
InChI Key:
JPJMNCROLRPFHI-QFIPXVFZSA-N
SMILES:
O=C(N[C@H](C(=O)ON1C(=O)CCC1=O)C(C)C)OCC1c2ccccc2c2c1cccc2
Properties
Complexity:
715
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
436.163g/mol
Formal Charge:
0
Heavy Atom Count:
32
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
436.464g/mol
Monoisotopic Mass:
436.163g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
102A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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