Sodium 3-(1-Naphthylamino)propanesulfonate - ≥98% , CAS No.104484-71-1

CAS: 104484-71-1 Cat. No.: S123044 Peso molecular: 287.31 PubChem CID: 23672139

GRADE & PURITY ≥98%

Synonyms

SB82096 | AKOS015909451 | 1-Propanesulfonic acid, 3-(1-naphthalenylamino)-, monosodium salt | HY-D0897 | AM85461 | 1-Propanesulfonicacid,3-(1-naphthalenylamino)-,sodiumsalt(1:1) | Sodium 3-(naphthalen-1-ylamino)propane-1-sulfonate | SCHEMBL10907208 | TD81

Storage

Store at 2-8°C,Argon charged

Shipped In

Wet ice

Specifications

Sinónimos

SB82096 | AKOS015909451 | 1-Propanesulfonic acid, 3-(1-naphthalenylamino)-, monosodium salt | HY-D0897 | AM85461 | 1-Propanesulfonicacid, 3-(1-naphthalenylamino)-, sodiumsalt(1:1) | Sodium 3-(naphthalen-1-ylamino)propane-1-sulfonate | SCHEMBL10907208 | TD81

Especificaciones y pureza

≥98%

Condiciones de almacenamiento de almacenamiento

Store at 2-8°C, Argon charged

Enviado en

Wet ice

Este producto requiere envío en cadena de frío. Los servicios terrestres y otros servicios económicos no están disponibles.

Pureza

≥98%

Nombres e identificadores

• Pubchem Sid: 504769576
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504769576
• Sonrisas canónicas: C1=CC=C2C(=C1)C=CC=C2NCCCS(=O)(=O)[O-].[Na+]
• IUPAC Name: sodium;3-(naphthalen-1-ylamino)propane-1-sulfonate
• InChIKey: HSOPFPPLFWZKJN-UHFFFAOYSA-M
• INCHI: 1S/C13H15NO3S.Na/c15-18(16,17)10-4-9-14-13-8-3-6-11-5-1-2-7-12(11)13;/h1-3,5-8,14H,4,9-10H2,(H,15,16,17);/q;+1/p-1
• Isómeros SMILES: C1=CC=C2C(=C1)C=CC=C2NCCCS(=O)(=O)[O-].[Na+]
• PubChem CID: 23672139
• Peso molecular: 287.31

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Clase Naphthalenes

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Clase: Naphthalenes
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Naphthalenes
• Alternative Parents: Secondary alkylarylamines Sulfonyls Organosulfonic acids Alkanesulfonic acids Organic zwitterions Organic sodium salts Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aromatic homopolycyclic compounds
• Substituents: Naphthalene - Secondary aliphatic/aromatic amine - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Organosulfonic acid - Sulfonyl - Alkanesulfonic acid - Secondary amine - Organic alkali metal salt - Organic zwitterion - Organosulfur compound - Organonitrogen compound - Organic nitrogen compound - Amine - Organic oxygen compound - Organic salt - Organic sodium salt - Hydrocarbon derivative - Organic oxide - Aromatic homopolycyclic compound
• Descripción: 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

Propiedades químicas y físicas

• Solubilidad: Soluble in water
• Sensibilidad: Air&heat sensitive
• Peso molecular: 287.310 g/mol
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 5
• Exact Mass: 287.059 Da
• Monoisotopic Mass: 287.059 Da
• Topological Polar Surface Area: 77.600 Ų
• Heavy Atom Count: 19
• Formal Charge: 0
• Complexity: 355.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 2

XLogP3

Referencias

1. Longhao Zhang, Hao Yan, JiaJia Zhou, Ziguang Zhao, Jin Huang, Lie Chen, Yunfei Ru, Mingjie Liu.  (2022)  High-Performance Organohydrogel Artificial Muscle with Compartmentalized Anisotropic Actuation Under Microdomain Confinement.  ADVANCED MATERIALS,  35  (9): (2202193).  [PMID:36543760] [10.1002/adma.202202193]