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1779133-79-7 | 4-(3-Methoxyphenyl)piperidin-4-amine dihydrochloride
CAS No: 1779133-79-7 Catalog No: AG01F8LK MDL No:
Product Description
Catalog Number:
AG01F8LK
Chemical Name:
4-(3-Methoxyphenyl)piperidin-4-amine dihydrochloride
CAS Number:
1779133-79-7
Molecular Formula:
C12H20Cl2N2O
Molecular Weight:
279.2060
IUPAC Name:
4-(3-methoxyphenyl)piperidin-4-amine;dihydrochloride
InChI:
InChI=1S/C12H18N2O.2ClH/c1-15-11-4-2-3-10(9-11)12(13)5-7-14-8-6-12;;/h2-4,9,14H,5-8,13H2,1H3;2*1H
InChI Key:
KOSYLUMABUFSIS-UHFFFAOYSA-N
SMILES:
COc1cccc(c1)C1(N)CCNCC1.Cl.Cl
Properties
Complexity:
202
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
278.095g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
279.205g/mol
Monoisotopic Mass:
278.095g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
47.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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