1-Pyrenedodecanoic acid - for fluorescence analysis, ≥98%(HPLC) , CAS No.69168-45-2

CAS: 69168-45-2 Cat. No.: P131286 Molecular Weight: 400.552 Beilstein Registry Number: 2481235 EC Number: 634-738-5

GRADE & PURITY for Fluorescence analysis, ≥98%(HPLC)

Synonyms

12-(pyren-1-yl)dodecanoic acid | MFCD00080927 | 1-PYRENEDODECANOICACID | AS-60176 | 12-pyren-1-yldodecanoic acid | pyrene-dodecanoic acid | 12-Pdda | DTXSID00219216 | J-100227 | 12-(pyren-1-yl)dodecanoicacid | 1-Pyrenedodecanoic acid, suitable for fluores

Storage

Store at 2-8°C

Shipped In

Wet ice

Overview

1-pyrenedodecanoic acid is a fluorescent fatty acid analog used as a probe in FCM to study the uptake of fluorescent fatty acids into cultured cells.
Anionic membrane probe. Studies on the uptake of fluorescent fatty acids into cultured cells。

Specifications

Synonyms

12-(pyren-1-yl)dodecanoic acid | MFCD00080927 | 1-PYRENEDODECANOICACID | AS-60176 | 12-pyren-1-yldodecanoic acid | pyrene-dodecanoic acid | 12-Pdda | DTXSID00219216 | J-100227 | 12-(pyren-1-yl)dodecanoicacid | 1-Pyrenedodecanoic acid, suitable for fluores

Specifications & Purity

for fluorescence analysis, ≥98%(HPLC)

Storage

Store at 2-8°C

Shipped In

Wet ice

This product requires cold chain shipping. Ground and other economy services are not available.

Grade

for Fluorescence analysis

Purity

≥98%(HPLC)

Names and Identifiers

• Pubchem Sid: 504756741
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504756741
• Canonical Smiles: C1=CC2=C3C(=C1)C=CC4=C(C=CC(=C43)C=C2)CCCCCCCCCCCC(=O)O
• IUPAC Name: 12-pyren-1-yldodecanoic acid
• InChIKey: JORFLUCVQONOPN-UHFFFAOYSA-N
• INCHI: 1S/C28H32O2/c29-26(30)14-9-7-5-3-1-2-4-6-8-11-21-15-16-24-18-17-22-12-10-13-23-19-20-25(21)28(24)27(22)23/h10,12-13,15-20H,1-9,11,14H2,(H,29,30)
• Isomeric SMILES: C1=CC2=C3C(=C1)C=CC4=C(C=CC(=C43)C=C2)CCCCCCCCCCCC(=O)O
• WGK Germany: 3
• Molecular Weight: 400.552
• Beilstein: 2481235
• Reaxy-Rn: 2481235
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2481235&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Class Pyrenes

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Class: Pyrenes
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Pyrenes
• Alternative Parents: Phenanthrenes and derivatives Long-chain fatty acids Naphthalenes Monocarboxylic acids and derivatives Carboxylic acids Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aromatic homopolycyclic compounds
• Substituents: Pyrene - Phenanthrene - Long-chain fatty acid - Naphthalene - Fatty acyl - Fatty acid - Monocarboxylic acid or derivatives - Carboxylic acid - Carboxylic acid derivative - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Aromatic homopolycyclic compound
• Description: This compound belongs to the class of organic compounds known as pyrenes. These are compounds containing a pyrene moiety, which consists four fused benzene rings, resulting in a flat aromatic system.
• 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

Chemical and Physical Properties

• Molecular Weight: 400.600 g/mol
• XLogP3: 9.500
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 12
• Exact Mass: 400.24 Da
• Monoisotopic Mass: 400.24 Da
• Topological Polar Surface Area: 37.300 Ų
• Heavy Atom Count: 30
• Formal Charge: 0
• Complexity: 529.000
• 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: 1

References

1. Libin Chen, Chonghui Ji, Degui Zhou, Xin Gou, Jianian Tang, Yongjie Jiang, Jingluan Han, Yao-Guang Liu, Letian Chen, Yongyao Xie.  (2022)  OsLTP47 may function in a lipid transfer relay essential for pollen wall development in rice.  Journal of Genetics and Genomics,      [PMID:35331929] [10.1016/j.jgg.2022.03.003]

2. Shijian Liu, Sijie Shao, Zhe Huang, Panpan Xue, Shuangqian Yan, Mengru Cao, Xuemei Zeng.  (2025)  A multifunctional manganese-based nanozyme platform for synergistic hypoxia alleviation and cholesterol depletion to potentiate STING-mediated cancer immunotherapy.  BIOMATERIALS,      [PMID:41045760] [10.1016/j.biomaterials.2025.123760]