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B60002

[(1R)-(endo,anti)]-(+)-3-Bromocamphor-8-sulfonic acid ammonium salt

Name: [(1R)-(endo,anti)]-(+)-3-Bromocamphor-8-sulfonic acid ammonium salt
Brand: ALDRICH

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About This Item

Empirical Formula (Hill Notation):

C₁₀H₁₅BrO₄S · NH₃

CAS Number:

14575-84-9

Molecular Weight:

328.22

NACRES:

NA.22

PubChem Substance ID:

24891887

UNSPSC Code:

12352115

EC Number:

238-616-9

MDL number:

MFCD00167438

Assay:

99%

Form:

powder

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Properties

assay

99%

form

powder

optical activity

[α]25/D +84.5°, c = 4 in H₂O

mp

284 °C (dec.) (lit.)

SMILES string

N.C[C@@]1(CS(O)(=O)=O)[C@@H]2CC[C@@]1(C)C(=O)[C@H]2Br

InChI

1S/C10H15BrO4S.H3N/c1-9-4-3-6(7(11)8(9)12)10(9,2)5-16(13,14)15;/h6-7H,3-5H2,1-2H3,(H,13,14,15);1H3/t6-,7+,9+,10-;/m1./s1

InChI key

GFBVBBRNPGPROZ-ZEMXJPTRSA-N

Description

Application

[(1R)-(endo,anti)]-(+)-3-Bromocamphor-8-sulfonic acid ammonium salt can be used as a chiral resolving reagent in the resolution of piperidine intermediate, which is used in the synthesis of ORL-1 antagonist named J-113397.

Storage Class

11 - Combustible Solids

wgk

WGK 3

flash_point_f

Not applicable

flash_point_c

Not applicable

ppe

dust mask type N95 (US), Eyeshields, Gloves

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A new synthesis of the ORL-1 antagonist 1-[(3R, 4R)-1-cyclooctylmethyl-3-hydroxymethyl-4-piperidinyl]-3-ethyl-1, 3-dihydro-2H-benzimidazol-2-one (J-113397) and activity in a calcium mobilization assay

Smith ED, et al.

Bioorganic & Medicinal Chemistry, 16(2), 822-829 (2008)

Global Trade Item Number

SKU	GTIN
B60002-5G	04061833434383