Home Carbonyls 3-(1-[(tert-Butoxy)carbonyl]piperidin-3-yl)benzoic acid

3-(1-[(tert-Butoxy)carbonyl]piperidin-3-yl)benzoic acid

CAS No.:
908334-19-0
Catalog Number:
AG00IKWF
Molecular Formula:
C17H23NO4
Molecular Weight:
305.3688
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
97%
1 week
United States
$360
- +
5g
97%
1 week
United States
$1007
- +
Product Description
Catalog Number:
AG00IKWF
Chemical Name:
3-(1-[(tert-Butoxy)carbonyl]piperidin-3-yl)benzoic acid
CAS Number:
908334-19-0
Molecular Formula:
C17H23NO4
Molecular Weight:
305.3688
MDL Number:
MFCD02178900
IUPAC Name:
3-[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-3-yl]benzoic acid
InChI:
InChI=1S/C17H23NO4/c1-17(2,3)22-16(21)18-9-5-8-14(11-18)12-6-4-7-13(10-12)15(19)20/h4,6-7,10,14H,5,8-9,11H2,1-3H3,(H,19,20)
InChI Key:
OWIOBHQKBBEWRW-UHFFFAOYSA-N
SMILES:
O=C(N1CCCC(C1)c1cccc(c1)C(=O)O)OC(C)(C)C
Properties
Complexity:
415  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
305.163g/mol
Formal Charge:
0
Heavy Atom Count:
22  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
305.374g/mol
Monoisotopic Mass:
305.163g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
66.8A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  
Properties