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147081-29-6 | (S)-4-N-Boc-2-Methyl Piperazine
CAS No: 147081-29-6 Catalog No: AG00382G MDL No:MFCD02683204
Product Description
Catalog Number:
AG00382G
Chemical Name:
(S)-4-N-Boc-2-Methyl Piperazine
CAS Number:
147081-29-6
Molecular Formula:
C10H20N2O2
Molecular Weight:
200.2780
MDL Number:
MFCD02683204
IUPAC Name:
tert-butyl (3S)-3-methylpiperazine-1-carboxylate
InChI:
InChI=1S/C10H20N2O2/c1-8-7-12(6-5-11-8)9(13)14-10(2,3)4/h8,11H,5-7H2,1-4H3/t8-/m0/s1
InChI Key:
FMLPQHJYUZTHQS-QMMMGPOBSA-N
SMILES:
C[C@@H]1NCCN(C1)C(=O)OC(C)(C)C
Properties
Complexity:
211
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
200.152g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
200.282g/mol
Monoisotopic Mass:
200.152g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
41.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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