Home Carbonyls (2R)‐2‐{[(tert‐butoxy)carbonyl]amino}‐2‐cycloheptylacetic acid

(2R)‐2‐{[(tert‐butoxy)carbonyl]amino}‐2‐cycloheptylacetic acid

CAS No.:
1860033-48-2
Catalog Number:
AG00I1Q9
Molecular Formula:
C14H25NO4
Molecular Weight:
271.3526
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Product Description
Catalog Number:
AG00I1Q9
Chemical Name:
(2R)‐2‐{[(tert‐butoxy)carbonyl]amino}‐2‐cycloheptylacetic acid
CAS Number:
1860033-48-2
Molecular Formula:
C14H25NO4
Molecular Weight:
271.3526
MDL Number:
MFCD29060189
IUPAC Name:
(2R)-2-cycloheptyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]acetic acid
InChI:
InChI=1S/C14H25NO4/c1-14(2,3)19-13(18)15-11(12(16)17)10-8-6-4-5-7-9-10/h10-11H,4-9H2,1-3H3,(H,15,18)(H,16,17)/t11-/m1/s1
InChI Key:
ADXRJYZTIHABDG-LLVKDONJSA-N
SMILES:
O=C(OC(C)(C)C)N[C@H](C1CCCCCC1)C(=O)O
Properties
Complexity:
314  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
271.178g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
271.357g/mol
Monoisotopic Mass:
271.178g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
75.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5  
Properties