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TRI(PROPYLENE GLYCOL) BUTYL ETHER structure
TRI(PROPYLENE GLYCOL) BUTYL ETHER structure

TRI(PROPYLENE GLYCOL) BUTYL ETHER

CAS No.: 55934-93-5
Molecular Weight:248.35902
Modify Date.: 2022-11-01 07:27
Introduction:
TRI(PROPYLENE GLYCOL) BUTYL ETHER, with the chemical formula C12H26O4 and CAS registry number 55934-93-5, is a compound known for its applications as a solvent and a coalescing agent in various industries. This colorless liquid, also referred to as TPnB, is characterized by its propylene glycol and butyl ether functional groups. It is commonly used in paints, coatings, and cleaning products, where it helps to improve the flow and leveling of the formulations. TRI(PROPYLENE GLYCOL) BUTYL ETHER is also known for its low volatility and good solubility in water, making it a suitable choice for water-based systems. Overall, TRI(PROPYLENE GLYCOL) BUTYL ETHER plays a crucial role in enhancing the performance and stability of many products in the chemical industry.
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1. Names and Identifiers
1.1 Name
TRI(PROPYLENE GLYCOL) BUTYL ETHER
1.2 Synonyms

[2-(2-Butoxymethylethoxy)methylethoxy]propanol 2-(2-Butoxymethylethoxy)methylethoxy)propanol ARCOSOLV (R) TPNB BFTG Dalpad C Dowanol TPnB DOWANOL(TM) TPNB Propanol, [2-(2-butoxymethylethoxy)methylethoxy]- TPNB TRI(PROPYLENE GLYCOL) BUTYL ETHER Tri(propylene glycol) butyl ether,mixture of isomers Tripropylene glycol monobutyl ether Tripropylene glycol n-butyl ether TRIPROPYLENE GLYCOL NORMAL BUTYL ETHER Tripropyleneglycol butyl ether Tripropyleneglycolmonobutylether

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1.3 CAS No.
55934-93-5
1.4 CID
91948
1.5 EINECS(EC#)
259-910-3
1.6 Molecular Formula
C13H28O4 (isomer)
1.7 Inchi
InChI=1S/C13H28O4/c1-4-15-7-5-6-13(3)17-9-8-16-11-12(2)10-14/h12-14H,4-11H2,1-3H3
1.8 InChIkey
QVIFIIFBFORLSL-UHFFFAOYSA-N
1.9 Canonical Smiles
CCOCCCC(C)OCCOCC(C)CO
1.10 Isomers Smiles
CCOCCCC(C)OCCOCC(C)CO
2. Properties
2.1 Density
0.953
2.1 Melting point
?75 °C(lit.)
2.1 Boiling point
276 °C(lit.)
2.1 Refractive index
n20/D 1.432(lit.)
2.1 Flash Point
156.1°C
2.1 Precise Quality
248.19900
2.1 PSA
47.92000
2.1 logP
1.99890
3. Safety and Handling
3.1 Safety Statements
23-24/25
3.1 WGK Germany
1
4. MSDS

2.Hazard identification

2.1 Classification of the substance or mixture

Not classified.

2.2 GHS label elements, including precautionary statements

Pictogram(s) No symbol.
Signal word

No signal word.

Hazard statement(s)

none

Precautionary statement(s)
Prevention

none

Response

none

Storage

none

Disposal

none

2.3 Other hazards which do not result in classification

none

6. Computational chemical data
  • Molecular Weight: 248.35902g/mol
  • Molecular Formula: C13H28O4
  • Compound Is Canonicalized: True
  • XLogP3-AA: 1.4
  • Exact Mass: 248.19875937
  • Monoisotopic Mass: 248.19875937
  • Complexity: 152
  • Rotatable Bond Count: 12
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 4
  • Topological Polar Surface Area: 47.9
  • Heavy Atom Count: 17
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count: 2
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Isotope Atom Count: 0
  • Covalently-Bonded Unit Count: 1
  • CACTVS Substructure Key Fingerprint: AAADceBwOAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAGgAACAAADRSggAICAAAABgAAAAAAAAAAAAAAAAAAAAAAAAABEAIAAAACQAAFAAACAADAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA==
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