Home Carbonyls (2S)-2-{[(tert-butoxy)carbonyl]amino}-3-(propan-2-yloxy)propanoic acid

(2S)-2-{[(tert-butoxy)carbonyl]amino}-3-(propan-2-yloxy)propanoic acid

CAS No.:
711018-10-9
Catalog Number:
AG01C25B
Molecular Formula:
C11H21NO5
Molecular Weight:
247.2881
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Product Description
Catalog Number:
AG01C25B
Chemical Name:
(2S)-2-{[(tert-butoxy)carbonyl]amino}-3-(propan-2-yloxy)propanoic acid
CAS Number:
711018-10-9
Molecular Formula:
C11H21NO5
Molecular Weight:
247.2881
MDL Number:
MFCD30342670
IUPAC Name:
(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-propan-2-yloxypropanoic acid
InChI:
InChI=1S/C11H21NO5/c1-7(2)16-6-8(9(13)14)12-10(15)17-11(3,4)5/h7-8H,6H2,1-5H3,(H,12,15)(H,13,14)/t8-/m0/s1
InChI Key:
RDQRLWWKIWKXNI-QMMMGPOBSA-N
SMILES:
CC(OC[C@@H](C(=O)O)NC(=O)OC(C)(C)C)C
Properties
Complexity:
270  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
247.142g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
247.291g/mol
Monoisotopic Mass:
247.142g/mol
Rotatable Bond Count:
7  
Topological Polar Surface Area:
84.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  
Properties