Home Carboxys benzyl 3,5-dimethylpiperazine-1-carboxylate hydrochloride

benzyl 3,5-dimethylpiperazine-1-carboxylate hydrochloride

CAS No.:
1803600-54-5
Catalog Number:
AG01AFP8
Molecular Formula:
C14H21ClN2O2
Molecular Weight:
284.7817
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Product Description
Catalog Number:
AG01AFP8
Chemical Name:
benzyl 3,5-dimethylpiperazine-1-carboxylate hydrochloride
CAS Number:
1803600-54-5
Molecular Formula:
C14H21ClN2O2
Molecular Weight:
284.7817
MDL Number:
MFCD27920212
IUPAC Name:
benzyl 3,5-dimethylpiperazine-1-carboxylate;hydrochloride
InChI:
InChI=1S/C14H20N2O2.ClH/c1-11-8-16(9-12(2)15-11)14(17)18-10-13-6-4-3-5-7-13;/h3-7,11-12,15H,8-10H2,1-2H3;1H
InChI Key:
XNSJNYIJYTYLMM-UHFFFAOYSA-N
SMILES:
CC1NC(C)CN(C1)C(=O)OCc1ccccc1.Cl
Properties
Complexity:
267  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
284.129g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
284.784g/mol
Monoisotopic Mass:
284.129g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
41.6A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
Properties