2-(4-Butylphenyl)acetic Acid - CAS 14377-19-6
Catalog: |
BB009664 |
Product Name: |
2-(4-Butylphenyl)acetic Acid |
CAS: |
14377-19-6 |
Synonyms: |
2-(4-butylphenyl)acetic acid; 2-(4-butylphenyl)acetic acid |
IUPAC Name: | 2-(4-butylphenyl)acetic acid |
Description: | 2-(4-Butylphenyl)acetic Acid (CAS# 14377-19-6) is a useful research chemical. |
Molecular Weight: | 192.25 |
Molecular Formula: | C12H16O2 |
Canonical SMILES: | CCCCC1=CC=C(C=C1)CC(=O)O |
InChI: | InChI=1S/C12H16O2/c1-2-3-4-10-5-7-11(8-6-10)9-12(13)14/h5-8H,2-4,9H2,1H3,(H,13,14) |
InChI Key: | ROVMLIKBAVUPPB-UHFFFAOYSA-N |
Boiling Point: | 318.8 °C at 760 mmHg |
LogP: | 2.65630 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P273, 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-2021134503-A1 | Separator | 20191231 |
WO-2021130492-A1 | Carboxy derivatives with antiinflammatory properties | 20191223 |
WO-2020150417-A2 | Compounds and compositions for treating conditions associated with sting activity | 20190117 |
TW-202043198-A | Compounds and compositions for treating conditions associated with sting activity | 20190117 |
US-2019100710-A1 | Ester Compounds, Lubricating Oil Compositions Containing Same and Processes for Making Same | 20170929 |
Complexity: | 169 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 192.115029749 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 192.115029749 |
Rotatable Bond Count: | 5 |
Topological Polar Surface Area: | 37.3 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.4 |
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