1,2-Propanediol - electronic grade, UP grade, ≥99% , CAS No.57-55-6

CAS: 57-55-6 Cat. No.: P1523622 分子式: C₃H₈O₂ 分子量: 76.09 Beilstein Registry Number: 1340498 EC番号: 200-338-0

グレード＆純度 Electronic grade, UP grade, ≥99%

Synonyms

1,2-PDO | 1,2-(RS)-Propanediol | propylene glycerol | propylenglycol | (±)-1,2-Propanediol

Storage

Protected from light,Room temperature,Argon charged

Shipped In

Normal

概要

1,2-Propanediol can be obtained as a byproduct in the dehydration of glycerol to hydroxyacetone.It can undergo condensation with sebacic acid and citric acid in the absence of catalyst to give poly((1,2-propanediol-sebacate)-citrate) (PPSC), an elastomeric polyester, which can find applications in tissue engineering and drug delivery.
Purpose
1,2-Propanediol has been used:
for removing excess Oil Red O stain in zebrafish larvae.
in the preparation of alginate hydrogels.
for the dissolution of androstenone.
for the calibration of cone beam scanner in computed tomography.

仕様

同義語

1,2-PDO | 1,2-(RS)-Propanediol | propylene glycerol | propylenglycol | (±)-1,2-Propanediol

仕様と純度

electronic grade, UP grade, ≥99%

保管条件

Protected from light,Room temperature,Argon charged

入荷

Normal

等級

UPクラス, 電子グレード

純度

≥99%

名前と識別子

カノニカル・スマイル

CC(CO)O

IUPAC Name

propane-1,2-diol

InChIKey

DNIAPMSPPWPWGF-UHFFFAOYSA-N

INCHI

1S/C3H8O2/c1-3(5)2-4/h3-5H,2H2,1H3

異性体SMILES

CC(CO)O

WGKドイツ

1

RTECS

TY2000000

分子量

76.09

Beilstein

1340498

Reaxy-Rn

1340498

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1340498&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic oxygen compounds
    • 分類 Organooxygen compounds
      • Subclass Alcohols and polyols
        • Level5 Polyols
          • Level6 1,2-diols

• Kingdom: Organic compounds
• Superclass: Organic oxygen compounds
• 分類: Organooxygen compounds
• Subclass: Alcohols and polyols
• Intermediate Tree Nodes: Polyols
• Direct Parent: 1,2-diols
• Alternative Parents: Secondary alcohols Primary alcohols Hydrocarbon derivatives
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Secondary alcohol - 1,2-diol - Hydrocarbon derivative - Primary alcohol - Aliphatic acyclic compound
• 説明: This compound belongs to the class of organic compounds known as 1,2-diols. These are polyols containing an alcohol group at two adjacent positions.
• External Descriptors: DL-12-Propanediol

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

化学的性質と物理的性質

• 溶解度: Soluble in acetone, chloroform, and ether
• 感度: Light and Moisture Sensitive
• 屈折率: 1.432-1.434
• 引火点（°F）: 210.2℉
• 引火点（°C）: 99℃
• 沸点（°C）: 188.2°C
• 融点（°C）: -59°C(lit.)
• 分子量: 76.090 g/mol
• XLogP3: -0.900
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 76.0524 Da
• Monoisotopic Mass: 76.0524 Da
• Topological Polar Surface Area: 40.500 Ų
• Heavy Atom Count: 5
• Formal Charge: 0
• Complexity: 20.900
• Isotope Atom Count: 0
• 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