Home Carbonyls 3-{[(tert-butoxy)carbonyl]amino}-3-cycloheptylpropanoic acid

3-{[(tert-butoxy)carbonyl]amino}-3-cycloheptylpropanoic acid

CAS No.:
776330-72-4
Catalog Number:
AG01EKCR
Molecular Formula:
C15H27NO4
Molecular Weight:
285.3792
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Product Description
Catalog Number:
AG01EKCR
Chemical Name:
3-{[(tert-butoxy)carbonyl]amino}-3-cycloheptylpropanoic acid
CAS Number:
776330-72-4
Molecular Formula:
C15H27NO4
Molecular Weight:
285.3792
MDL Number:
MFCD31629230
IUPAC Name:
3-cycloheptyl-3-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid
InChI:
InChI=1S/C15H27NO4/c1-15(2,3)20-14(19)16-12(10-13(17)18)11-8-6-4-5-7-9-11/h11-12H,4-10H2,1-3H3,(H,16,19)(H,17,18)
InChI Key:
PKTCOTNRFSPARU-UHFFFAOYSA-N
SMILES:
O=C(OC(C)(C)C)NC(C1CCCCCC1)CC(=O)O
Properties
Complexity:
327  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
285.194g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
285.384g/mol
Monoisotopic Mass:
285.194g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
75.6A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4  
Properties