Home Halogens 1-[(tert-Butyl)oxycarbonyl]-3-(4-chlorobenzyl)piperidine-3-carboxylic acid

1-[(tert-Butyl)oxycarbonyl]-3-(4-chlorobenzyl)piperidine-3-carboxylic acid

CAS No.:
174606-16-7
Catalog Number:
AG001ZSK
Molecular Formula:
C18H23ClNO4-
Molecular Weight:
352.8325
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
≥ 98% (HPLC)
1 week
United States
$96
- +
250mg
≥ 98% (HPLC)
1 week
United States
$148
- +
1g
≥ 98% (HPLC)
1 week
United States
$323
- +
5g
≥ 98% (HPLC)
1 week
United States
$1200
- +
Product Description
Catalog Number:
AG001ZSK
Chemical Name:
1-[(tert-Butyl)oxycarbonyl]-3-(4-chlorobenzyl)piperidine-3-carboxylic acid
CAS Number:
174606-16-7
Molecular Formula:
C18H23ClNO4-
Molecular Weight:
352.8325
MDL Number:
MFCD03840048
IUPAC Name:
3-[(4-chlorophenyl)methyl]-1-[(2-methylpropan-2-yl)oxycarbonyl]piperidine-3-carboxylic acid
InChI:
InChI=1S/C18H24ClNO4/c1-17(2,3)24-16(23)20-10-4-9-18(12-20,15(21)22)11-13-5-7-14(19)8-6-13/h5-8H,4,9-12H2,1-3H3,(H,21,22)
InChI Key:
NFBWLXLJPIEKQE-UHFFFAOYSA-N
SMILES:
Clc1ccc(cc1)CC1(CCCN(C1)C(=O)OC(C)(C)C)C(=O)[O-]
Properties
Complexity:
468  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
353.139g/mol
Formal Charge:
0
Heavy Atom Count:
24  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
353.843g/mol
Monoisotopic Mass:
353.139g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
66.8A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5  
Properties