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82499-91-0 | 1-(2-METHYLBUTYL)PIPERAZINE
CAS No: 82499-91-0 Catalog No: AG004UIW MDL No:
Product Description
Catalog Number:
AG004UIW
Chemical Name:
1-(2-METHYLBUTYL)PIPERAZINE
CAS Number:
82499-91-0
Molecular Formula:
C9H20N2
Molecular Weight:
156.2685
IUPAC Name:
1-(2-methylbutyl)piperazine
InChI:
InChI=1S/C9H20N2/c1-3-9(2)8-11-6-4-10-5-7-11/h9-10H,3-8H2,1-2H3
InChI Key:
OQGIVRAAJBHOTH-UHFFFAOYSA-N
SMILES:
CCC(CN1CCNCC1)C
Properties
Complexity:
97.7
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
156.163g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
156.273g/mol
Monoisotopic Mass:
156.163g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
15.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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