Home Carbonyls 3-(Tert-Butoxycarbonyl)-3-Azabicyclo[3.3.1]Nonane-9-Carboxylic Acid

3-(Tert-Butoxycarbonyl)-3-Azabicyclo[3.3.1]Nonane-9-Carboxylic Acid

CAS No.:
1198466-18-0
Catalog Number:
AG00HF5H
Molecular Formula:
C14H23NO4
Molecular Weight:
269.3367
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Product Description
Catalog Number:
AG00HF5H
Chemical Name:
3-(Tert-Butoxycarbonyl)-3-Azabicyclo[3.3.1]Nonane-9-Carboxylic Acid
CAS Number:
1198466-18-0
Molecular Formula:
C14H23NO4
Molecular Weight:
269.3367
MDL Number:
MFCD18792906
IUPAC Name:
3-[(2-methylpropan-2-yl)oxycarbonyl]-3-azabicyclo[3.3.1]nonane-9-carboxylic acid
InChI:
InChI=1S/C14H23NO4/c1-14(2,3)19-13(18)15-7-9-5-4-6-10(8-15)11(9)12(16)17/h9-11H,4-8H2,1-3H3,(H,16,17)
InChI Key:
VWIXGZCJQXOWMF-UHFFFAOYSA-N
SMILES:
O=C(N1CC2CCCC(C1)C2C(=O)O)OC(C)(C)C
Properties
Complexity:
360  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
269.163g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
269.341g/mol
Monoisotopic Mass:
269.163g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
66.8A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
2  
Properties