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Home Carboxys 1-(tert-Butoxycarbonyl)-4-(4-fluorophenyl)piperidine-4-carboxylic acid

1-(tert-Butoxycarbonyl)-4-(4-fluorophenyl)piperidine-4-carboxylic acid

CAS No.:
644981-89-5
Catalog Number:
AG00ED41
Molecular Formula:
C17H22FNO4
Molecular Weight:
323.3593
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
≥ 98% (HPLC)
1 week
United States
$170
- +
250mg
≥ 98% (HPLC)
1 week
United States
$301
- +
1g
≥ 98% (HPLC)
1 week
United States
$594
- +
5g
≥ 98% (HPLC)
1 week
United States
$2728
- +
Product Description
Catalog Number:
AG00ED41
Chemical Name:
1-(tert-Butoxycarbonyl)-4-(4-fluorophenyl)piperidine-4-carboxylic acid
CAS Number:
644981-89-5
Molecular Formula:
C17H22FNO4
Molecular Weight:
323.3593
MDL Number:
MFCD05861568
IUPAC Name:
4-(4-fluorophenyl)-1-[(2-methylpropan-2-yl)oxycarbonyl]piperidine-4-carboxylic acid
InChI:
InChI=1S/C17H22FNO4/c1-16(2,3)23-15(22)19-10-8-17(9-11-19,14(20)21)12-4-6-13(18)7-5-12/h4-7H,8-11H2,1-3H3,(H,20,21)
InChI Key:
OBWPBURFIWEBBY-UHFFFAOYSA-N
SMILES:
OC(=O)C1(CCN(CC1)C(=O)OC(C)(C)C)c1ccc(cc1)F
Properties
Complexity:
444  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
323.153g/mol
Formal Charge:
0
Heavy Atom Count:
23  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
323.364g/mol
Monoisotopic Mass:
323.153g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
66.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7  
Properties