Home Carbonyls 2-{[(tert-butoxy)carbonyl]amino}-4-(diethylamino)butanoic acid

2-{[(tert-butoxy)carbonyl]amino}-4-(diethylamino)butanoic acid

CAS No.:
1404688-53-4
Catalog Number:
AG01A1A7
Molecular Formula:
C13H26N2O4
Molecular Weight:
274.3565
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Product Description
Catalog Number:
AG01A1A7
Chemical Name:
2-{[(tert-butoxy)carbonyl]amino}-4-(diethylamino)butanoic acid
CAS Number:
1404688-53-4
Molecular Formula:
C13H26N2O4
Molecular Weight:
274.3565
MDL Number:
MFCD19401092
IUPAC Name:
4-(diethylamino)-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoic acid
InChI:
InChI=1S/C13H26N2O4/c1-6-15(7-2)9-8-10(11(16)17)14-12(18)19-13(3,4)5/h10H,6-9H2,1-5H3,(H,14,18)(H,16,17)
InChI Key:
OSOZDWXLSALQHO-UHFFFAOYSA-N
SMILES:
CCN(CCC(C(=O)O)NC(=O)OC(C)(C)C)CC
Properties
Complexity:
296  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
274.189g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
274.361g/mol
Monoisotopic Mass:
274.189g/mol
Rotatable Bond Count:
9  
Topological Polar Surface Area:
78.9A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.6  
Properties