3-(tert-Butoxy)propionic acid - CAS 21150-73-2
Catalog: |
BB016653 |
Product Name: |
3-(tert-Butoxy)propionic acid |
CAS: |
21150-73-2 |
Synonyms: |
3-[(2-methylpropan-2-yl)oxy]propanoic acid |
IUPAC Name: | 3-[(2-methylpropan-2-yl)oxy]propanoic acid |
Description: | 3-tert-Butoxypropionic Acid can be used as an anti-tumor agent. It can also be used for its antibacterial properties. |
Molecular Weight: | 146.18 |
Molecular Formula: | C7H14O3 |
Canonical SMILES: | CC(C)(C)OCCC(=O)O |
InChI: | InChI=1S/C7H14O3/c1-7(2,3)10-5-4-6(8)9/h4-5H2,1-3H3,(H,8,9) |
InChI Key: | KXZYUJNAHMNZBA-UHFFFAOYSA-N |
Boiling Point: | 70-72 °C / 0.22 mmHg |
Density: | 0.989 g/mL at 20 °C (lit.) |
Appearance: | Colorless to yellowish liquid |
MDL: | MFCD03426042 |
LogP: | 1.27620 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CN-109608335-A | A kind of preparation method of 3- tert-butoxy propanoic acid tert-butyl ester | 20190129 |
WO-2020095253-A1 | Peptide compounds, conjugates thereof, and uses thereof | 20181108 |
CA-3011880-A1 | New substituted cyanoindoline derivatives as nik inhibitors | 20160122 |
EP-3405196-B1 | New substituted cyanoindoline derivatives as nik inhibitors | 20160122 |
US-2021087182-A1 | New substituted cyanoindoline derivatives as nik inhibitors | 20160122 |
Complexity: | 113 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 146.094294304 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 146.094294304 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 46.5 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.6 |
Online Inquiry
Customer Support
Customer Centered
Related Functional Groups
Carbonyl Compounds
Customers Also Viewed
INDUSTRY LEADERS TRUST OUR PRODUCTS