SSR 180711 hydrochloride - ≥98% , CAS No.446031-79-4

CAS: 446031-79-4 Cat. No.: S286563 Molecular Weight: 361.66 PubChem CID: 9928899
AVAILABLE TO ORDER
GRADE & PURITY ≥98%
Synonyms
SSR-180711C | 1,4-Diazabicyclo(3.2.2)nonane-4-carboxylic acid, 4-bromophenyl ester, monohydrochloride | SSR180711 (hydrochloride) | SCHEMBL2910246 | SSR180711Hydrochloride | 2ZY6YR5A3C | 4-Bromophenyl 1,4-diazabicyclo(3.2.2)nonane-4-carboxylate monohydroc
Storage
Protected from light,Store at -20°C
Shipped In
Ice chest + Ice pads
 ·  off list, applied to all prices below.
Size
Status
Price
Qty
5mg
S286563-5mg
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.
$147.90
10mg
S286563-10mg
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.
$239.90
50mg
S286563-50mg
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.
$1,059.90
100mg
S286563-100mg
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.
$1,679.90
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Why this grade

≥98% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

🌡

Storage & shipping

Protected from light,Store at -20°C Ships Ice chest + Ice pads Check lot-specific COA for exact specifications.

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Quality documents

SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.

📚

Literature proof

Cited in 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Specifications

Synonyms
SSR-180711C | 1, 4-Diazabicyclo(3.2.2)nonane-4-carboxylic acid, 4-bromophenyl ester, monohydrochloride | SSR180711 (hydrochloride) | SCHEMBL2910246 | SSR180711Hydrochloride | 2ZY6YR5A3C | 4-Bromophenyl 1, 4-diazabicyclo(3.2.2)nonane-4-carboxylate monohydroc
Specifications & Purity
≥98%
Biochemical and Physiological Mechanisms
Partial agonist atα7 nAChR. Enhances episodic memory and reversesMK-801-induced deficits in retention of episodic memory. Increases extracellular dopamine levels in rat prefrontal cortex. Also exhibits antidepressant-like properties.
Storage
Protected from light, Store at -20°C
Shipped In
Ice chest + Ice pads
This product requires cold chain shipping. Ground and other economy services are not available.
Purity
≥98%
Names and Identifiers
Canonical SmilesC1CN2CCC1N(CC2)C(=O)OC3=CC=C(C=C3)Br.Cl
IUPAC Name(4-bromophenyl) 1,4-diazabicyclo[3.2.2]nonane-4-carboxylate;hydrochloride
InChIKeyYNBXNVUZXFMNSJ-UHFFFAOYSA-N
INCHI1S/C14H17BrN2O2.ClH/c15-11-1-3-13(4-2-11)19-14(18)17-10-9-16-7-5-12(17)6-8-16;/h1-4,12H,5-10H2;1H
Isomeric SMILES C1CN2CCC1N(CC2)C(=O)OC3=CC=C(C=C3)Br.Cl
PubChem CID 9928899
Molecular Weight 361.66

Documentation

📋 Safety Data Sheet (SDS)

Comprehensive hazard, handling, storage, and regulatory compliance document.

Download SDS →

✅ Certificate of Analysis (COA)

Lot-specific quality data. Enter your lot number to retrieve the exact COA.

Look up COA →

📊 Datasheet

Quick-reference summary of product specifications and applications.

View datasheet →

🔬 Specification Sheet

Full quality attributes and acceptance criteria for this grade.

View spec sheet →

Advanced Data

Taxonomic Classification

Taxonomy Tree

KingdomOrganic compounds
SuperclassBenzenoids
ClassBenzene and substituted derivatives
SubclassPhenoxy compounds
Intermediate Tree Nodes Not available
Direct ParentPhenoxy compounds
Alternative Parents Bromobenzenes  1,4-diazepanes  Piperidines  Aryl bromides  Carbamate esters  Trialkylamines  Azacyclic compounds  Organobromides  Organic oxides  Hydrochlorides  Hydrocarbon derivatives  Carbonyl compounds  
Molecular FrameworkAromatic heteropolycyclic compounds
Substituents Phenoxy compound - 1,4-diazepane - Bromobenzene - Diazepane - Halobenzene - Aryl bromide - Aryl halide - Piperidine - Carbamic acid ester - Tertiary aliphatic amine - Tertiary amine - Azacycle - Organoheterocyclic compound - Organic nitrogen compound - Organonitrogen compound - Organobromide - Organohalogen compound - Organooxygen compound - Hydrochloride - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Amine - Aromatic heteropolycyclic compound
DescriptionThis compound belongs to the class of organic compounds known as phenoxy compounds. These are aromatic compounds contaning a phenoxy group.
External Descriptors Not available
3D Structure
Interactive Chemical Structure Model





Certificates(CoA,COO,BSE/TSE and Analysis Chart)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:
Chemical and Physical Properties
SolubilitySolvent:water, Max Conc. mg/mL: 36.17, Max Conc. mM: 100; Solvent:DMSO, Max Conc. mg/mL: 36.17, Max Conc. mM: 100
SensitivityHeat sensitivel; Moisture sensitive;Light sensitive
Molecular Weight361.660 g/mol
XLogP3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Exact Mass360.024 Da
Monoisotopic Mass360.024 Da
Topological Polar Surface Area32.800 Ų
Heavy Atom Count20
Formal Charge0
Complexity323.000
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
The total count of all stereochemical bonds0
Covalently-Bonded Unit Count2
Solution Calculators
Reviews

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