3-(3-Hydroxylphenyl)propanol - CAS 621-54-5
Catalog: |
BB031445 |
Product Name: |
3-(3-Hydroxylphenyl)propanol |
CAS: |
621-54-5 |
Synonyms: |
Dihydro-m-coumaric Acid; NSC 33135; NSC 39468; m-Hydroxyphenylpropionic Acid; β-(3-Hydroxyphenyl)propionic Acid; β-(m-Hydroxyphenyl)propionic Acid; 3-(m-Hydroxyphenyl)propionic Acid; 3-Hydroxybenzenepropanoic Acid; 3-Hydroxydihydrocinnamic Acid; m-Hydroxyhydrocinnamic Acid; 3-(3-Hydroxyphenyl)propionic Acid |
IUPAC Name: | 3-(3-hydroxyphenyl)propanoic acid |
Description: | 3-(3-Hydroxylphenyl)propanol is a natural product found in Ginkgo biloba and Trypanosoma brucei. |
Molecular Weight: | 166.17 |
Molecular Formula: | C9H10O3 |
Canonical SMILES: | C1=CC(=CC(=C1)O)CCC(=O)O |
InChI: | InChI=1S/C9H10O3/c10-8-3-1-2-7(6-8)4-5-9(11)12/h1-3,6,10H,4-5H2,(H,11,12) |
InChI Key: | QVWAEZJXDYOKEH-UHFFFAOYSA-N |
Boiling Point: | 354.5±17.0°C at 760 mmHg |
Melting Point: | 111-114°C |
Purity: | ≥95% |
Density: | 1.260±0.1 g/cm3 (Predicted) |
Solubility: | Soluble in DMSO (Slightly), Methanol (Slightly) |
Appearance: | Pale Beige to Light Brown Solid |
Storage: | Store at 2-8°C |
LogP: | 1.40940 |
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-113189219-A | Method for predicting curative effect and adverse reaction of pemetrexed chemotherapy based on metabonomics | 20210418 |
CN-111758942-A | Blueberry jelly and preparation method thereof | 20200522 |
CN-111485422-A | Anti-mite antibacterial finishing agent and finishing method and application thereof | 20200417 |
WO-2021119554-A1 | Compositions and methods for potentiating immune activity | 20191212 |
JP-2021080183-A | New lysophosphatidic acid derivative | 20191114 |
PMID | Publication Date | Title | Journal |
29981789 | 20181001 | Protective effects of (-)-epicatechin and the colonic metabolite 3,4-dihydroxyphenylacetic acid against glucotoxicity-induced insulin signalling blockade and altered glucose uptake and production in renal tubular NRK-52E cells | Food and chemical toxicology : an international journal published for the British Industrial Biological Research Association |
26186273 | 20150805 | Identification of Echinacoside Metabolites Produced by Human Intestinal Bacteria Using Ultraperformance Liquid Chromatography-Quadrupole Time-of-Flight Mass Spectrometry | Journal of agricultural and food chemistry |
22372405 | 20120328 | Impact of short-term intake of red wine and grape polyphenol extract on the human metabolome | Journal of agricultural and food chemistry |
22383957 | 20120101 | F420H2-dependent degradation of aflatoxin and other furanocoumarins is widespread throughout the actinomycetales | PloS one |
22557976 | 20120101 | Metabolomic applications to decipher gut microbial metabolic influence in health and disease | Frontiers in physiology |
Complexity: | 156 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 166.062994177 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 166.062994177 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 57.5 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