2-Isopropyloxazole-4-carboxylic Acid - CAS 153180-21-3
Catalog: |
BB010858 |
Product Name: |
2-Isopropyloxazole-4-carboxylic Acid |
CAS: |
153180-21-3 |
Synonyms: |
2-propan-2-yl-4-oxazolecarboxylic acid; 2-propan-2-yl-1,3-oxazole-4-carboxylic acid |
IUPAC Name: | 2-propan-2-yl-1,3-oxazole-4-carboxylic acid |
Description: | 2-Isopropyloxazole-4-carboxylic Acid (CAS# 153180-21-3) is a useful research chemical. |
Molecular Weight: | 155.15 |
Molecular Formula: | C7H9NO3 |
Canonical SMILES: | CC(C)C1=NC(=CO1)C(=O)O |
InChI: | InChI=1S/C7H9NO3/c1-4(2)6-8-5(3-11-6)7(9)10/h3-4H,1-2H3,(H,9,10) |
InChI Key: | RNFLNLHKYIYMNK-UHFFFAOYSA-N |
Boiling Point: | 277.2 °C at 760 mmHg |
Density: | 1.3 g/cm3 |
LogP: | -0.04010 |
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 |
WO-2020135771-A1 | Heterocyclic compound intermediate, preparation method therefor and application thereof | 20181229 |
TW-201927756-A | Integrating stress pathway regulator | 20171102 |
BR-112020008839-A2 | modulators of the integrated stress pathway | 20171102 |
EP-3710428-A1 | Modulators of the integrated stress pathway | 20171102 |
KR-20200096522-A | Modulators of the integrated stress pathway | 20171102 |
Complexity: | 158 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 155.058243149 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 155.058243149 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 63.3 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.4 |
Online Inquiry
Customer Support
Customer Centered
Related Functional Groups
Carbonyl Compounds
Customers Also Viewed
INDUSTRY LEADERS TRUST OUR PRODUCTS