3-(3-Methoxyphenyl)isoxazole-5-carboxylic acid - CAS 883546-38-1
Catalog: |
BB048409 |
Product Name: |
3-(3-Methoxyphenyl)isoxazole-5-carboxylic acid |
CAS: |
883546-38-1 |
Synonyms: |
3-(3-Methoxy-phenyl)-isoxazole-5-carboxylic acid; 5-isoxazolecarboxylic acid, 3-(3-methoxyphenyl)-; 3-(3-methoxyphenyl)-5-isoxazolecarboxylic acid |
IUPAC Name: | 3-(3-methoxyphenyl)-1,2-oxazole-5-carboxylic acid |
Description: | 3-(3-Methoxyphenyl)isoxazole-5-carboxylic acid (CAS# 883546-38-1 ) is a useful research chemical. |
Molecular Weight: | 219.19 |
Molecular Formula: | C11H9NO4 |
Canonical SMILES: | COC1=CC=CC(=C1)C2=NOC(=C2)C(=O)O |
InChI: | InChI=1S/C11H9NO4/c1-15-8-4-2-3-7(5-8)9-6-10(11(13)14)16-12-9/h2-6H,1H3,(H,13,14) |
InChI Key: | OTKLXXDOCKHVEX-UHFFFAOYSA-N |
Boiling Point: | 452.0±35.0 °C (Predicted) |
Purity: | ≥ 95 % |
Density: | 1.310±0.06 g/cm3 (Predicted) |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]; H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]; H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation] |
Precautionary Statement: | P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 |
Signal Word: | Warning |
Complexity: | 258 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 219.05315777 |
Formal Charge: | 0 |
Heavy Atom Count: | 16 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 219.05315777 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 72.6 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.9 |
Online Inquiry
Customer Support
Customer Centered
Related Functional Groups
Carbonyl Compounds
Isoxazoles
Customers Also Viewed
-
[30879-49-3]
2'-Nitro-5'-hydroxyacetophenone
-
[70406-92-7]
N-(6-Amino-2,3-dichlorobenzyl)glycine ethyl ester
-
[56507-37-0]
Metribuzin-diketo
-
[1643-20-5]
N,N-dimethyldodecan-1-amine oxide
-
[44994-28-7]
N,N,N',N'-Tetramethyl-1,5-pentanediamine
-
[30360-19-1]
N,N'-Diethyl-N''-isopropyl-1,3,5-triazine-2,4,6-triamine
INDUSTRY LEADERS TRUST OUR PRODUCTS