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144599-95-1 | L-Tryptophan, N,1-bis[(1,1-dimethylethoxy)carbonyl]-
CAS No: 144599-95-1 Catalog No: AG001JTI MDL No:MFCD00270520
Product Description
Catalog Number:
AG001JTI
Chemical Name:
L-Tryptophan, N,1-bis[(1,1-dimethylethoxy)carbonyl]-
CAS Number:
144599-95-1
Molecular Formula:
C21H28N2O6
Molecular Weight:
404.4568
MDL Number:
MFCD00270520
IUPAC Name:
(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-[1-[(2-methylpropan-2-yl)oxycarbonyl]indol-3-yl]propanoic acid
InChI:
InChI=1S/C21H28N2O6/c1-20(2,3)28-18(26)22-15(17(24)25)11-13-12-23(19(27)29-21(4,5)6)16-10-8-7-9-14(13)16/h7-10,12,15H,11H2,1-6H3,(H,22,26)(H,24,25)/t15-/m0/s1
InChI Key:
FATGZMFSCKUQGO-HNNXBMFYSA-N
SMILES:
O=C(OC(C)(C)C)N[C@H](C(=O)O)Cc1cn(c2c1cccc2)C(=O)OC(C)(C)C
Properties
Complexity:
622
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
404.195g/mol
Formal Charge:
0
Heavy Atom Count:
29
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
404.463g/mol
Monoisotopic Mass:
404.195g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
107A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9
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