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Structure

3-Tropanyl-3,5-dichlorobenzoate

CAS
40796-97-2
Catalog Number
ACM40796972
Category
Other Products
Molecular Weight
314.21
Molecular Formula
C15H17Cl2NO2

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Specification

Synonyms
BEMESETRON, Tocris-0640, Bemesetron (USAN/INN), Lopac-T-8160, Tropyl 3,5-dichlorobenzoate, CID671690, MDL 72222, MDL-72222, PDSP2_001503, NCGC00016058-01, NCGC00024702-01, D03073, (1R,5S)-8-methyl-8-azabicyclo[3.2.1]oct-3-yl 3,5-dichlorobenzoate, 40796-97-2
IUPAC Name
[(1S,5R)-8-methyl-8-azabicyclo[3.2.1]octan-3-yl] 3,5-dichlorobenzoate
Canonical SMILES
CN1C2CCC1CC(C2)OC(=O)C3=CC(=CC(=C3)Cl)Cl
InChI Key
MNJNPLVXBISNSX-PBWFPOADSA-N
Boiling Point
406.507ºC at 760 mmHg
Flash Point
199.648ºC
Density
1.344g/cm³
Exact Mass
313.06400
H-Bond Acceptor
3
H-Bond Donor
0
Safety Description
36
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