Home Carbonyls 4-([(tert-butoxy)carbonyl]amino)-2-ethylbutanoic acid

4-([(tert-butoxy)carbonyl]amino)-2-ethylbutanoic acid

CAS No.:
1780649-12-8
Catalog Number:
AG01EKGS
Molecular Formula:
C11H21NO4
Molecular Weight:
231.2887
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Product Description
Catalog Number:
AG01EKGS
Chemical Name:
4-([(tert-butoxy)carbonyl]amino)-2-ethylbutanoic acid
CAS Number:
1780649-12-8
Molecular Formula:
C11H21NO4
Molecular Weight:
231.2887
MDL Number:
MFCD24544685
IUPAC Name:
2-ethyl-4-[(2-methylpropan-2-yl)oxycarbonylamino]butanoic acid
InChI:
InChI=1S/C11H21NO4/c1-5-8(9(13)14)6-7-12-10(15)16-11(2,3)4/h8H,5-7H2,1-4H3,(H,12,15)(H,13,14)
InChI Key:
BDRCIETWVHQBHF-UHFFFAOYSA-N
SMILES:
CCC(C(=O)O)CCNC(=O)OC(C)(C)C
Properties
Complexity:
245  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
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:
7  
Topological Polar Surface Area:
75.6A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Properties