TCEP Solution - 0.5M , CAS No.5961-85-3

CAS: 5961-85-3 Cat. No.: T725368 분자식: C₉H₁₅O₆P 분자량: 250.19

GRADE & PURITY 0.5M

Storage

Store at 2-8°C

Shipped In

Wet ice

Specifications

사양 및 순도

0.5M

보관 조건

Store at 2-8°C

배송

Wet ice

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제품 특성

• ALogP: -1.6

이름과 식별자

• Pubchem Sid: 528769149
• 정식 스마일: C(CP(CCC(=O)O)CCC(=O)O)C(=O)O
• IUPAC Name: 3-[bis(2-carboxyethyl)phosphanyl]propanoic acid
• InChIKey: PZBFGYYEXUXCOF-UHFFFAOYSA-N
• INCHI: 1S/C9H15O6P/c10-7(11)1-4-16(5-2-8(12)13)6-3-9(14)15/h1-6H2,(H,10,11)(H,12,13)(H,14,15)
• 이성체 SMILES: C(CP(CCC(=O)O)CCC(=O)O)C(=O)O
• 분자량: 250.19

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic acids and derivatives
    • 분류 Carboxylic acids and derivatives
      • Subclass Tricarboxylic acids and derivatives

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• 분류: Carboxylic acids and derivatives
• Subclass: Tricarboxylic acids and derivatives
• Intermediate Tree Nodes: Not available
• Direct Parent: Tricarboxylic acids and derivatives
• Alternative Parents: Organic phosphines and derivatives Carboxylic acids Organopnictogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Tricarboxylic acid or derivatives - Phosphine - Carboxylic acid - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organophosphorus compound - Organooxygen compound - Carbonyl group - Aliphatic acyclic compound
• 설명: This compound belongs to the class of organic compounds known as tricarboxylic acids and derivatives. These are carboxylic acids containing exactly three carboxyl groups.
• External Descriptors: tricarboxylic acid - phosphine derivative

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

화학 및 물리적 특성

• 분자량: 250.190 g/mol
• XLogP3: -1.600
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 9
• Exact Mass: 250.061 Da
• Monoisotopic Mass: 250.061 Da
• Topological Polar Surface Area: 112.000 Ų
• Heavy Atom Count: 16
• Formal Charge: 0
• Complexity: 222.000
• 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

참고 문헌

1. Hao Liu, Zhiming Liu, Hao Zhang, Ke Huang, Xiaohui Liu, Hui Jiang, Xuemei Wang.  (2024)  Mineralized aggregates based on native protein phase transition for non-destructive diagnosis of seborrheic skin by surface-enhanced Raman spectroscopy.  Materials Horizons,      [PMID:39086255] [10.1039/D4MH00613E]

2. Tong Li, Wang Jie, Ma Yunjin, Wang Chunying, Fu Yue, Li Qi, Gao Chengjiang, Song Hui, Qin Ying, Zhao Chunyuan, Zhao Wei.  (2025)  Viruses hijack FPN1 to disrupt iron withholding and suppress host defense.  Nature Communications,  16  (1): (1-14).  [PMID:40595467] [10.1038/s41467-025-60031-w]