Naphthalene-d8 - ≥99 atom% D,≥98% , CAS No.1146-65-2

CAS: 1146-65-2 Cat. No.: N141241 Peso molecular: 136.22 Número EC: 214-552-7

GRADE & PURITY ≥99 atom% D,≥98%

Synonyms

1,2,3,4,5,6,7,8-Octadeuterionaphthalene | Octadeutronaphthalene | J-003121 | AKOS015903735 | Perdeuterated naphthalene | Naphthalene D8 10 microg/mL in Cyclohexane | UFWIBTONFRDIAS-PGRXLJNUSA-N | D98914 | Naphthalene-d8 | Naphthalene D8 | Naphthalene-1,2,

Storage

Protected from light,Room temperature,Argon charged,Cool

Shipped In

Normal

Specifications

Sinónimos

1, 2, 3, 4, 5, 6, 7, 8-Octadeuterionaphthalene | Octadeutronaphthalene | J-003121 | AKOS015903735 | Perdeuterated naphthalene | Naphthalene D8 10 microg/mL in Cyclohexane | UFWIBTONFRDIAS-PGRXLJNUSA-N | D98914 | Naphthalene-d8 | Naphthalene D8 | Naphthalene-1, 2,

Especificaciones y pureza

≥99 atom% D, ≥98%

Condiciones de almacenamiento de almacenamiento

Protected from light, Room temperature, Argon charged, Cool

Enviado en

Normal

Pureza

≥99 atom% D, ≥98%

Nombres e identificadores

• Pubchem Sid: 504756104
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504756104
• Sonrisas canónicas: C1=CC=C2C=CC=CC2=C1
• IUPAC Name: 1,2,3,4,5,6,7,8-octadeuterionaphthalene
• InChIKey: UFWIBTONFRDIAS-PGRXLJNUSA-N
• INCHI: 1S/C10H8/c1-2-6-10-8-4-3-7-9(10)5-1/h1-8H/i1D,2D,3D,4D,5D,6D,7D,8D
• Isómeros SMILES: [2H]C1=C(C(=C2C(=C(C(=C(C2=C1[2H])[2H])[2H])[2H])[2H])[2H])[2H]
• CAS alternativo: 91-20-3(Unlabeled)
• Número ONU: 1334
• Grupo de embalaje: III
• Peso molecular: 136.22
• Reaxy-Rn: 1421310
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1421310&ln=

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: Aromatic hydrocarbons Polycyclic hydrocarbons Unsaturated hydrocarbons
• Molecular Framework: Aromatic homopolycyclic compounds
• Substituents: Naphthalene - Aromatic hydrocarbon - Polycyclic hydrocarbon - Unsaturated hydrocarbon - Hydrocarbon - 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

• Sensibilidad: Moisture sensitive；Light sensitive
• Punto de inflamación (°C): 78℃
• Punto de ebullición (°C): 218℃
• Punto de fusión (°C): 81-83℃
• Peso molecular: 136.220 g/mol
• XLogP3: 3.300
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 0
• Exact Mass: 136.113 Da
• Monoisotopic Mass: 136.113 Da
• Topological Polar Surface Area: 0.000 Ų
• Heavy Atom Count: 10
• Formal Charge: 0
• Complexity: 80.600
• Isotope Atom Count: 8
• 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: 1

Referencias

1. Xiaoyu Qiu, Weiwei Wang, Lige Zhang, Lihua Guo, Ping Xu, Hongzhi Tang.  (2021)  A thermophile Hydrogenibacillus sp. strain efficiently degrades environmental pollutants polycyclic aromatic hydrocarbons.  ENVIRONMENTAL MICROBIOLOGY,  24  (1): (436-450).  [PMID:34897956] [10.1111/1462-2920.15869]

2. Li Zhansheng, Zhao Hongxia, Li Xintong, Bekele Tadiyose Girma.  (2021)  Characteristics and sources of environmentally persistent free radicals in PM2.5 in Dalian, Northeast China: correlation with polycyclic aromatic hydrocarbons.  ENVIRONMENTAL SCIENCE AND POLLUTION RESEARCH,  29  (17): (24612-24622).  [PMID:34822091] [10.1007/s11356-021-17688-9]

3. Shu Zhu, Shangying Qin, Chonghui Wei, Li Cen, Luyun Xiong, Xingyu Luo, Yilin Wang.  (2024)  Acetylcholine triggered enzymatic cascade reaction based on Fe7S8 nanoflakes catalysis for organophosphorus pesticides visual detection.  ANALYTICA CHIMICA ACTA,      [PMID:38553122] [10.1016/j.aca.2024.342464]

4. Yaqi Wang, Ying Zhang, Yuanfeng Wang, Yahe Zhang, Chunming Xu, Zhiming Xu, Quan Shi, Linzhou Zhang.  (2025)  C10–C50 Olefins in Thermal Cracking Products of Heavy Petroleum: Characterization Using Ag+ ESI High-Resolution Mass Spectrometry.  ENERGY & FUELS,      [PMID:] [10.1021/acs.energyfuels.5c00143]

5. Xu Heng-Yu, Jiang Zhi-Cai, Lu Cheng-Fei, Li Mao-Song, Chen Zhao-Ding, Liu Li-Lan, Xu Shu-Ting, Liu Bo, Hu Jun.  (2025)  Rapid and sensitive detection of polycyclic aromatic hydrocarbons using electrochemically assisted derivatization mass spectrometry.  ANALYTICAL AND BIOANALYTICAL CHEMISTRY,      [PMID:41077596] [10.1007/s00216-025-06160-z]