2-Propoxyacetic Acid - CAS 54497-00-6
Catalog: |
BB028699 |
Product Name: |
2-Propoxyacetic Acid |
CAS: |
54497-00-6 |
Synonyms: |
2-propoxyacetic acid; 2-propoxyacetic acid |
IUPAC Name: | 2-propoxyacetic acid |
Description: | 2-Propoxyacetic Acid (CAS# 54497-00-6) is a useful research chemical. |
Molecular Weight: | 118.13 |
Molecular Formula: | C5H10O3 |
Canonical SMILES: | CCCOCC(=O)O |
InChI: | InChI=1S/C5H10O3/c1-2-3-8-4-5(6)7/h2-4H2,1H3,(H,6,7) |
InChI Key: | SGUYGLMQEOSQTH-UHFFFAOYSA-N |
Boiling Point: | 224.3 °C at 760 mmHg |
Density: | 1.054 g/cm3 |
MDL: | MFCD09744041 |
LogP: | 0.49760 |
GHS Hazard Statement: | H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation] |
Precautionary Statement: | P260, P261, P264, P271, P280, P301+P330+P331, P303+P361+P353, P304+P340, P305+P351+P338, P310, P312, P321, P363, P403+P233, P405, and P501 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
WO-2015140130-A1 | Oxadiazole compounds | 20140317 |
WO-2015140132-A1 | 2,7-diazaspiro[3.5]nonane compounds | 20140317 |
US-2015252057-A1 | Novel 6-fused heteroaryldihydropyrimidines for the treatment and prophylaxis of hepatitis B virus infection | 20140307 |
WO-2015132276-A1 | Novel 6-fused heteroaryldihydropyrimidines for the treatment and prophylaxis of hepatitis b virus infection | 20140307 |
WO-2015130957-A1 | Heterocyclic inhibitors of the sodium channel | 20140227 |
PMID | Publication Date | Title | Journal |
11466793 | 20010101 | Application of automated matrix-assisted laser desorption/ionization time-of-flight mass spectrometry for the measurement of enzyme activities | Rapid communications in mass spectrometry : RCM |
Complexity: | 70.1 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 118.062994177 |
Formal Charge: | 0 |
Heavy Atom Count: | 8 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 118.062994177 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 46.5 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.6 |
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