rac Propranolol-d7 - ≥98 atom% D,≥98% , CAS No.98897-23-5

CAS: 98897-23-5 Cat. No.: R334353 Formula: C₁₆H₁₄D₇NO₂ Peso molecolare: 266.39 Numero EC: 875-658-2 PubChem CID: 45040287

GRADE & PURITY ≥98 atom% D,≥98%

Synonyms

SS-4507 | HY-B0573BS | AKOS030255227 | 1-(naphthalen-1-yloxy)-3-{[(1,1,1,2,3,3,3-?H?)propan-2-yl]amino}propan-2-ol | Propranolol-d7 | rac-Propranolol-d7 | 1-[(1-Methylethyl-d7)amino]-3-(1-naphthalenyloxy)-2-propanol | rac Propranolol-d7 | SCHEMBL13781176

Storage

Store at -20°C

Shipped In

Ice chest + Ice pads

Panoramica

rac Propranolol-d7 is an anti-hypertensive, anti-anginal and anti-arrhythmic β-AR (β-Adrenergic receptor) blocker. rac Propranolol-d7 is an inhibitor of β-AR (β-Adrenergic receptor), PAP, SR and PKC.

Specifications

Sinonimi

SS-4507 | HY-B0573BS | AKOS030255227 | 1-(naphthalen-1-yloxy)-3-{[(1,1,1,2,3,3,3-?H?)propan-2-yl]amino}propan-2-ol | Propranolol-d7 | rac-Propranolol-d7 | 1-[(1-Methylethyl-d7)amino]-3-(1-naphthalenyloxy)-2-propanol | rac Propranolol-d7 | SCHEMBL13781176

Specifiche e purezza

≥98 atom% D,≥98%

Condizioni di conservazione di stoccaggio

Store at -20°C

Spedito in

Ice chest + Ice pads

Questo prodotto richiede spedizione a catena fredda. I servizi di terra e altri servizi economici non sono disponibili.

Tipo di azione

ANTAGONIST

Purezza

≥98 atom% D,≥98%

Nomi e identificatori

Sorrisi canonici

CC(C)NCC(COC1=CC=CC2=CC=CC=C21)O

IUPAC Name

1-(1,1,1,2,3,3,3-heptadeuteriopropan-2-ylamino)-3-naphthalen-1-yloxypropan-2-ol

InChIKey

AQHHHDLHHXJYJD-QLWPOVNFSA-N

INCHI

1S/C16H21NO2/c1-12(2)17-10-14(18)11-19-16-9-5-7-13-6-3-4-8-15(13)16/h3-9,12,14,17-18H,10-11H2,1-2H3/i1D3,2D3,12D

Isomeri SMILES

[2H]C([2H])([2H])C([2H])(C([2H])([2H])[2H])NCC(COC1=CC=CC2=CC=CC=C21)O

CAS alternativo

525-66-6 unlabelled

PubChem CID

45040287

Peso molecolare

266.39

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Classe Naphthalenes

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Classe: Naphthalenes
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Naphthalenes
• Alternative Parents: Phenol ethers Alkyl aryl ethers Secondary alcohols 1,2-aminoalcohols Dialkylamines Hydrocarbon derivatives
• Molecular Framework: Aromatic homopolycyclic compounds
• Substituents: Naphthalene - Phenol ether - Alkyl aryl ether - 1,2-aminoalcohol - Secondary alcohol - Secondary aliphatic amine - Secondary amine - Ether - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Amine - Organic oxygen compound - Alcohol - Aromatic homopolycyclic compound
• Descrizione: This compound belongs to the class of organic compounds known as naphthalenes. These are compounds containing a naphthalene moiety, which consists of two fused benzene rings.
• External Descriptors: Not available

Data sources

1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.

DOI: 10.1186/s13321-016-0174-y

Proprietà chimiche e fisiche

• Solubilità: Soluble in Chloroform and Dichloromethane
• Sensibilità: Hygroscopic
• Punto di ebollizione (°C): ~434.9° C at 760 mmHg (Predicted)
• Punto di fusione (°C): 90-92° C
• Peso molecolare: 266.390 g/mol
• XLogP3: 3.000
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 6
• Exact Mass: 266.201 Da
• Monoisotopic Mass: 266.201 Da
• Topological Polar Surface Area: 41.500 Ų
• Heavy Atom Count: 19
• Formal Charge: 0
• Complexity: 257.000
• Isotope Atom Count: 7
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 1
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1