Home Carboxys 4-({[(tert-butoxy)carbonyl](ethyl)amino}methyl)cyclohexane-1-carboxylic acid

4-({[(tert-butoxy)carbonyl](ethyl)amino}methyl)cyclohexane-1-carboxylic acid

CAS No.:
2137643-39-9
Catalog Number:
AG01EL2W
Molecular Formula:
C15H27NO4
Molecular Weight:
285.3792
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Product Description
Catalog Number:
AG01EL2W
Chemical Name:
4-({[(tert-butoxy)carbonyl](ethyl)amino}methyl)cyclohexane-1-carboxylic acid
CAS Number:
2137643-39-9
Molecular Formula:
C15H27NO4
Molecular Weight:
285.3792
MDL Number:
MFCD31558716
IUPAC Name:
4-[[ethyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]methyl]cyclohexane-1-carboxylic acid
InChI:
InChI=1S/C15H27NO4/c1-5-16(14(19)20-15(2,3)4)10-11-6-8-12(9-7-11)13(17)18/h11-12H,5-10H2,1-4H3,(H,17,18)
InChI Key:
KBTQPEGXSHURMJ-UHFFFAOYSA-N
SMILES:
CCN(C(=O)OC(C)(C)C)CC1CCC(CC1)C(=O)O
Properties
Complexity:
340  
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:
1  
Isotope Atom Count:
0
Molecular Weight:
285.384g/mol
Monoisotopic Mass:
285.194g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
66.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  
Properties