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1233951-79-5 | N-Isobutylpiperidine-4-amine dihydrochloride
CAS No: 1233951-79-5 Catalog No: AG01FAL1 MDL No:
Product Description
Catalog Number:
AG01FAL1
Chemical Name:
N-Isobutylpiperidine-4-amine dihydrochloride
CAS Number:
1233951-79-5
Molecular Formula:
C9H22Cl2N2
Molecular Weight:
229.1904
IUPAC Name:
N-(2-methylpropyl)piperidin-4-amine;dihydrochloride
InChI:
InChI=1S/C9H20N2.2ClH/c1-8(2)7-11-9-3-5-10-6-4-9;;/h8-11H,3-7H2,1-2H3;2*1H
InChI Key:
HZDCAYXHXIAEOL-UHFFFAOYSA-N
SMILES:
CC(CNC1CCNCC1)C.Cl.Cl
Properties
Complexity:
95.7
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
228.116g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
229.189g/mol
Monoisotopic Mass:
228.116g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
24.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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