3-(4-Carboxyphenyl)propionic acid - CAS 38628-51-2
Catalog: |
BB023718 |
Product Name: |
3-(4-Carboxyphenyl)propionic acid |
CAS: |
38628-51-2 |
Synonyms: |
4-(2-carboxyethyl)benzoic acid |
IUPAC Name: | 4-(2-carboxyethyl)benzoic acid |
Description: | 3-(4-Carboxyphenyl)propionic acid (CAS# 38628-51-2) is a useful research chemical. |
Molecular Weight: | 194.18 |
Molecular Formula: | C10H10O4 |
Canonical SMILES: | C1=CC(=CC=C1CCC(=O)O)C(=O)O |
InChI: | InChI=1S/C10H10O4/c11-9(12)6-3-7-1-4-8(5-2-7)10(13)14/h1-2,4-5H,3,6H2,(H,11,12)(H,13,14) |
InChI Key: | QSPCOYVUYYFWAU-UHFFFAOYSA-N |
Boiling Point: | 406.1 °C at 760 mmHg |
Melting Point: | 289-293 °C (lit.) |
Purity: | 95 % |
Density: | 1.33 g/cm3 |
MDL: | MFCD00016560 |
LogP: | 1.40200 |
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-2021084354-A1 | Wound dressing material and methods of making and using the same | 20191028 |
WO-2021063166-A1 | Ligand, coordinated quantum dot, quantum dot layer and patterning method therefor | 20190930 |
WO-2021059188-A1 | Wound dressing material and methods of making and using the same | 20190925 |
CN-110523434-A | A kind of carbon-based keggin type phosphato-molybdic heteropolyacid catalyst of solid and its application | 20190902 |
CN-110433859-A | A kind of carbon-based germanomolybdate catalyst of solid and its application | 20190809 |
PMID | Publication Date | Title | Journal |
22678955 | 20120709 | Control of interpenetration and gas-sorption properties of metal-organic frameworks by a simple change in ligand design | Chemistry (Weinheim an der Bergstrasse, Germany) |
21754451 | 20110501 | 4-Methyl-sulfanyl-6-(4-pyrid-yl)-1,3,5-triazin-2-amine | Acta crystallographica. Section E, Structure reports online |
Complexity: | 216 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 194.05790880 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 194.05790880 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 74.6 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1 |
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