Home Carboxys 3-[(4-Amino-benzylamino)-methyl]-piperidine-1-carboxylic acid tert-butyl ester

3-[(4-Amino-benzylamino)-methyl]-piperidine-1-carboxylic acid tert-butyl ester

CAS No.:
1189107-00-3
Catalog Number:
AG00754Y
Molecular Formula:
C18H29N3O2
Molecular Weight:
319.4418
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
In Stock USA
United States
$75
- +
250mg
In Stock USA
United States
$137
- +
500mg
In Stock USA
United States
$235
- +
1g
In Stock USA
United States
$394
- +
2.5g
In Stock USA
United States
$797
- +
5g
In Stock USA
United States
$1373
- +
10g
In Stock USA
United States
$2373
- +
Product Description
Catalog Number:
AG00754Y
Chemical Name:
3-[(4-Amino-benzylamino)-methyl]-piperidine-1-carboxylic acid tert-butyl ester
CAS Number:
1189107-00-3
Molecular Formula:
C18H29N3O2
Molecular Weight:
319.4418
MDL Number:
MFCD12674815
IUPAC Name:
tert-butyl 3-[[(4-aminophenyl)methylamino]methyl]piperidine-1-carboxylate
InChI:
InChI=1S/C18H29N3O2/c1-18(2,3)23-17(22)21-10-4-5-15(13-21)12-20-11-14-6-8-16(19)9-7-14/h6-9,15,20H,4-5,10-13,19H2,1-3H3
InChI Key:
GUAMKRWLEBSKSY-UHFFFAOYSA-N
SMILES:
Nc1ccc(cc1)CNCC1CCCN(C1)C(=O)OC(C)(C)C
Properties
Complexity:
373  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
319.226g/mol
Formal Charge:
0
Heavy Atom Count:
23  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
319.449g/mol
Monoisotopic Mass:
319.226g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
67.6A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  
Properties