Home Carbonyls Butanoic acid, 2-[[[(1,1-dimethylethoxy)carbonyl]amino]methyl]-3-methyl-, (2S)-

Butanoic acid, 2-[[[(1,1-dimethylethoxy)carbonyl]amino]methyl]-3-methyl-, (2S)-

CAS No.:
210346-16-0
Catalog Number:
AG002KPY
Molecular Formula:
C11H21NO4
Molecular Weight:
231.2887
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Product Description
Catalog Number:
AG002KPY
Chemical Name:
Butanoic acid, 2-[[[(1,1-dimethylethoxy)carbonyl]amino]methyl]-3-methyl-, (2S)-
CAS Number:
210346-16-0
Molecular Formula:
C11H21NO4
Molecular Weight:
231.2887
MDL Number:
MFCD07372879
IUPAC Name:
(2S)-3-methyl-2-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]butanoic acid
InChI:
InChI=1S/C11H21NO4/c1-7(2)8(9(13)14)6-12-10(15)16-11(3,4)5/h7-8H,6H2,1-5H3,(H,12,15)(H,13,14)/t8-/m1/s1
InChI Key:
IGJIQZVMCRTQQX-MRVPVSSYSA-N
SMILES:
O=C(OC(C)(C)C)NC[C@@H](C(=O)O)C(C)C
Properties
Complexity:
255  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
231.147g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
231.292g/mol
Monoisotopic Mass:
231.147g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
75.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  
Properties