Home Carboxys 4-(Benzyloxycarbonylamino)bicyclo[2.2.2]octane-1-carboxylic acid

4-(Benzyloxycarbonylamino)bicyclo[2.2.2]octane-1-carboxylic acid

CAS No.:
444344-91-6
Catalog Number:
AG00DKTO
Molecular Formula:
C17H21NO4
Molecular Weight:
303.3529
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
95%
1 week
United States
$527
- +
Product Description
Catalog Number:
AG00DKTO
Chemical Name:
4-(Benzyloxycarbonylamino)bicyclo[2.2.2]octane-1-carboxylic acid
CAS Number:
444344-91-6
Molecular Formula:
C17H21NO4
Molecular Weight:
303.3529
MDL Number:
MFCD22741481
IUPAC Name:
4-(phenylmethoxycarbonylamino)bicyclo[2.2.2]octane-1-carboxylic acid
InChI:
InChI=1S/C17H21NO4/c19-14(20)16-6-9-17(10-7-16,11-8-16)18-15(21)22-12-13-4-2-1-3-5-13/h1-5H,6-12H2,(H,18,21)(H,19,20)
InChI Key:
LFCUXTYUESPPGC-UHFFFAOYSA-N
SMILES:
O=C(NC12CCC(CC1)(CC2)C(=O)O)OCc1ccccc1
Properties
Complexity:
417  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
303.147g/mol
Formal Charge:
0
Heavy Atom Count:
22  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
303.358g/mol
Monoisotopic Mass:
303.147g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
75.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  
Properties