Home Carboxys methyl 3-(piperazin-1-yl)oxetane-3-carboxylate dihydrochloride

methyl 3-(piperazin-1-yl)oxetane-3-carboxylate dihydrochloride

CAS No.:
1803566-01-9
Catalog Number:
AG01AG31
Molecular Formula:
C9H18Cl2N2O3
Molecular Weight:
273.1568
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Product Description
Catalog Number:
AG01AG31
Chemical Name:
methyl 3-(piperazin-1-yl)oxetane-3-carboxylate dihydrochloride
CAS Number:
1803566-01-9
Molecular Formula:
C9H18Cl2N2O3
Molecular Weight:
273.1568
MDL Number:
MFCD27920326
IUPAC Name:
methyl 3-piperazin-1-yloxetane-3-carboxylate;dihydrochloride
InChI:
InChI=1S/C9H16N2O3.2ClH/c1-13-8(12)9(6-14-7-9)11-4-2-10-3-5-11;;/h10H,2-7H2,1H3;2*1H
InChI Key:
GZFREGTXBJVSPZ-UHFFFAOYSA-N
SMILES:
COC(=O)C1(COC1)N1CCNCC1.Cl.Cl
Properties
Complexity:
222  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
272.069g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
273.154g/mol
Monoisotopic Mass:
272.069g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
50.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties