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amberlite(r) irc-50

Catalog Number
ACM9002293
CAS Number
9002-29-3
Product Name
amberlite(r) irc-50
Category
Polymers
IUPAC Name
(9-amino-3-bicyclo[3.3.1]nonanyl)-(4-benzyl-5-methyl-1,4-diazepan-1-yl)methanone;dihydrochloride
Molecular Weight
442.5g/mol
Molecular Formula
C23H37Cl2N3O
Canonical SMILES
CC1CCN(CCN1CC2=CC=CC=C2)C(=O)C3CC4CCCC(C3)C4N.Cl.Cl
InChI
InChI=1S/C23H35N3O.2ClH/c1-17-10-11-25(12-13-26(17)16-18-6-3-2-4-7-18)23(27)21-14-19-8-5-9-20(15-21)22(19)24;;/h2-4,6-7,17,19-22H,5,8-16,24H2,1H3;2*1H
InChI Key
DPEYHNFHDIXMNV-UHFFFAOYSA-N
Complexity
490
Covalently-Bonded Unit Count
3
Exact Mass
441.231368g/mol
Formal Charge
0
Heavy Atom Count
29
MeSH Entry Terms
Amberlite IRC50
Monoisotopic Mass
441.231368g/mol
Rotatable Bond Count
3
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