Home Carbonyls 2-{[(tert-butoxy)carbonyl]amino}-8-oxononanoic acid

2-{[(tert-butoxy)carbonyl]amino}-8-oxononanoic acid

CAS No.:
1822564-20-4
Catalog Number:
AG01C254
Molecular Formula:
C14H25NO5
Molecular Weight:
287.3520
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Product Description
Catalog Number:
AG01C254
Chemical Name:
2-{[(tert-butoxy)carbonyl]amino}-8-oxononanoic acid
CAS Number:
1822564-20-4
Molecular Formula:
C14H25NO5
Molecular Weight:
287.3520
MDL Number:
MFCD24541282
IUPAC Name:
2-[(2-methylpropan-2-yl)oxycarbonylamino]-8-oxononanoic acid
InChI:
InChI=1S/C14H25NO5/c1-10(16)8-6-5-7-9-11(12(17)18)15-13(19)20-14(2,3)4/h11H,5-9H2,1-4H3,(H,15,19)(H,17,18)
InChI Key:
KZKYSBGFAXFTBU-UHFFFAOYSA-N
SMILES:
CC(=O)CCCCCC(C(=O)O)NC(=O)OC(C)(C)C
Properties
Complexity:
346  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
287.173g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
287.356g/mol
Monoisotopic Mass:
287.173g/mol
Rotatable Bond Count:
10  
Topological Polar Surface Area:
92.7A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  
Properties