CAS
42437-50-3 Purity
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42437-50-3 Purity
96%
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Benafentrine
CAS
35135-01-4
Catalog Number
ACM35135014
Category
Other Products
Molecular Weight
393.484
Molecular Formula
C23H27N3O3
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Specification
Synonyms
Benafentrine;rel-N-[4-[(4aR,10bS)-1,2,3,4,4a,10b-Hexahydro-8,9-dimethoxy-2-methylbenzo[c][1,6]naphthyridin-6-yl]phenyl]acetamide;N-[4-(1,2,3,4,4aβ,10bβ-Hexahydro-8,9-dimethoxy-2-methylbenzo[c][1,6]naphthyridin-6-yl)phenyl]acetamide
IUPAC Name
N-[4-[(4aS,10bR)-8,9-dimethoxy-2-methyl-3,4,4a,10b-tetrahydro-1H-benzo[c][1,6]naphthyridin-6-yl]phenyl]acetamide
Canonical SMILES
CC(=O)NC1=CC=C(C=C1)C2=NC3CCN(CC3C4=CC(=C(C=C42)OC)OC)C
InChI Key
DCDXHGMCXGHXBM-PMACEKPBSA-N
Boiling Point
558.5ºC at 760mmHg
Flash Point
291.6ºC
Density
1.24g/cm³
Exact Mass
393.20500
H-Bond Acceptor
5
H-Bond Donor
1
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