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1227610-42-5 | Piperazine, 1-cyclobutyl-2-methyl-, hydrochloride (1:2), (2S)-
CAS No: 1227610-42-5 Catalog No: AG000JFC MDL No:MFCD09907868
Product Description
Catalog Number:
AG000JFC
Chemical Name:
Piperazine, 1-cyclobutyl-2-methyl-, hydrochloride (1:2), (2S)-
CAS Number:
1227610-42-5
Molecular Formula:
C9H20Cl2N2
Molecular Weight:
227.1745
MDL Number:
MFCD09907868
IUPAC Name:
(2S)-1-cyclobutyl-2-methylpiperazine;dihydrochloride
InChI:
InChI=1S/C9H18N2.2ClH/c1-8-7-10-5-6-11(8)9-3-2-4-9;;/h8-10H,2-7H2,1H3;2*1H/t8-;;/m0../s1
InChI Key:
ROUKMLQHHLVWOM-JZGIKJSDSA-N
SMILES:
C[C@H]1CNCCN1C1CCC1.Cl.Cl
Properties
Complexity:
132
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
226.1g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
227.173g/mol
Monoisotopic Mass:
226.1g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
15.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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