2-Butyl-2-ethyl-1,3-propanediol - CAS 115-84-4
Catalog: |
BB003633 |
Product Name: |
2-Butyl-2-ethyl-1,3-propanediol |
CAS: |
115-84-4 |
Synonyms: |
2-butyl-2-ethylpropane-1,3-diol |
IUPAC Name: | 2-butyl-2-ethylpropane-1,3-diol |
Description: | 2-Butyl-2-ethyl-1,3-propanediol (CAS# 115-84-4) is a compound used as a biocidal substance for prevention of bacterial or fungal growth in medical, cosmetic, cleaning, and food products. |
Molecular Weight: | 160.25 |
Molecular Formula: | C9H20O2 |
Canonical SMILES: | CCCCC(CC)(CO)CO |
InChI: | InChI=1S/C9H20O2/c1-3-5-6-9(4-2,7-10)8-11/h10-11H,3-8H2,1-2H3 |
InChI Key: | DSKYSDCYIODJPC-UHFFFAOYSA-N |
Boiling Point: | 178 °C / 50 mmHg |
Melting Point: | 43 °C |
Flash Point: | 137°C |
Purity: | 99 % |
Density: | 0.93 g/cm3 |
Solubility: | water, 1042 mg/L @ 25 °C (est) |
Appearance: | White to almost white powder to crystal |
Storage: | Sealed in dry, Room Temperature |
MDL: | MFCD00004697 |
LogP: | 1.55760 |
Refractive Index: | 1.455 |
GHS Hazard Statement: | H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation] |
Precautionary Statement: | P264, P280, P305+P351+P338, and P337+P313 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CN-113336925-A | Saturated polyester resin and preparation method thereof | 20210603 |
JP-6948485-B1 | Anchor coating agent for melt extrusion lamination and laminate | 20210602 |
CN-113337246-A | Photo-curing hot melt adhesive for difficult-to-adhere base material and preparation method thereof | 20210601 |
CN-113248694-A | Super-weather-resistant flexible polyester resin and preparation method thereof | 20210423 |
JP-6930675-B1 | Rosin-modified phenolic resin, lithographic printing inks, and printed matter | 20210421 |
PMID | Publication Date | Title | Journal |
16099656 | 20051001 | Tyrosine-phosphorylated bacterial effector proteins: the enemies within | Trends in microbiology |
12199599 | 20020815 | Characterization of polyesters prepared from three different phthalic acid isomers by CID-ESI-FT-ICR and PSD-MALDI-TOF mass spectrometry | Analytical chemistry |
Complexity: | 87.6 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 160.146329876 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 160.146329876 |
Rotatable Bond Count: | 6 |
Topological Polar Surface Area: | 40.5 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.8 |
Online Inquiry
Customer Support
Customer Centered
Related Functional Groups
Oxygen Compounds
Customers Also Viewed
INDUSTRY LEADERS TRUST OUR PRODUCTS