Home Carboxys methyl 3-amino-1-benzylpiperidine-3-carboxylate dihydrochloride

methyl 3-amino-1-benzylpiperidine-3-carboxylate dihydrochloride

CAS No.:
1955492-35-9
Catalog Number:
AG01B2GX
Molecular Formula:
C14H22Cl2N2O2
Molecular Weight:
321.2427
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Product Description
Catalog Number:
AG01B2GX
Chemical Name:
methyl 3-amino-1-benzylpiperidine-3-carboxylate dihydrochloride
CAS Number:
1955492-35-9
Molecular Formula:
C14H22Cl2N2O2
Molecular Weight:
321.2427
MDL Number:
MFCD29991604
IUPAC Name:
methyl 3-amino-1-benzylpiperidine-3-carboxylate;dihydrochloride
InChI:
InChI=1S/C14H20N2O2.2ClH/c1-18-13(17)14(15)8-5-9-16(11-14)10-12-6-3-2-4-7-12;;/h2-4,6-7H,5,8-11,15H2,1H3;2*1H
InChI Key:
MQINTCTTZNOOKJ-UHFFFAOYSA-N
SMILES:
COC(=O)C1(N)CCCN(C1)Cc1ccccc1.Cl.Cl
Properties
Complexity:
290  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
320.106g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
321.242g/mol
Monoisotopic Mass:
320.106g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
55.6A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties