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Merck
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Documents

155322

Sigma-Aldrich

trans-Styrylacetic acid

greener alternative

96%

Synonyme(s) :

4-Phenyl-3-butenoic acid

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About This Item

Formule linéaire :
C6H5CH=CHCH2CO2H
Numéro CAS:
1914-58-5
Poids moléculaire :
162.19
Numéro MDL:
MFCD00002783
Code UNSPSC :
12352100
ID de substance PubChem :
24849516
Nomenclature NACRES :
NA.22

Pureté

96%

Score du produit alternatif plus écologique

old score: 22
new score: 3
Find out more about DOZN™ Scoring

Caractéristiques du produit alternatif plus écologique

Atom Economy
Design for Energy Efficiency
Use of Renewable Feedstocks
Learn more about the Principles of Green Chemistry.

sustainability

Greener Alternative Product

Pf

84-86 °C (lit.)

Autre catégorie plus écologique

, Re-engineered

Chaîne SMILES 

OC(=O)C\C=C\c1ccccc1

InChI

1S/C10H10O2/c11-10(12)8-4-7-9-5-2-1-3-6-9/h1-7H,8H2,(H,11,12)/b7-4+

Clé InChI

PSCXFXNEYIHJST-QPJJXVBHSA-N

Catégories apparentées

Description générale

The polarized IR spectra of the hydrogen bond system in trans-styrylacetic acid has been studied.
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Application

trans-Styrylacetic acid (4-Phenyl-3-butenoic acid) was used as mechanism-based inhibitor of Peptidylglycine α-hydroxylating monooxygenase.

Pictogrammes

Exclamation mark
GHS07

Mention d'avertissement

Warning

Mentions de danger

H315,H319,H335

Classification des risques

Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3

Organes cibles

Respiratory system

Code de la classe de stockage

11 - Combustible Solids

Classe de danger pour l'eau (WGK)

WGK 3

Point d'éclair (°F)

Not applicable

Point d'éclair (°C)

Not applicable

Équipement de protection individuelle

dust mask type N95 (US), Eyeshields, Gloves

Certificats d'analyse (COA)

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Henryk T Flakus et al.
Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy, 65(2), 481-489 (2006-03-11)
We have investigated the polarized IR spectra of the hydrogen bond system in crystals of trans-styrylacetic acid C(6)H(5)CHCHCH(2)COOH, and also in crystals of the following three deuterium isotopomers of the compound: C(6)H(5)CHCHCH(2)COOD, C(6)H(5)CHCHCD(2)COOH and C(6)H(5)CHCHCD(2)COOD. The spectra were measured at
J Scognamiglio et al.
Food and chemical toxicology : an international journal published for the British Industrial Biological Research Association, 50 Suppl 2, S120-S123 (2011-10-29)
A toxicologic and dermatologic review of 4-phenyl-3-buten-2-ol when used as a fragrance ingredient is presented. 4-Phenyl-3-buten-2-ol is a member of the fragrance structural group Aryl Alkyl Alcohols and is a secondary alcohol. The AAAs are a structurally diverse class of
G A Abou-Mohamed et al.
Journal of cardiovascular pharmacology, 35(6), 871-880 (2000-06-03)
Formation of mature active neuropeptides such as substance P (SP) from their glycine extended precursors entails alpha-amidation of peptide precursors by the sequential enzymatic action of peptidylglycine alpha-monooxygenase (PAM) and peptidylamidoglycolate lyase (PGL). We reported that these two enzymes that
Jee Yeon Lee et al.
International journal of systematic and evolutionary microbiology, 55(Pt 1), 257-262 (2005-01-18)
A 4-phenyl-3-butenoic acid-producing actinomycete, designated strain VK-A60T, was isolated from a soil sample collected from Koyang, Korea. Morphological and chemical characteristics of the strain were consistent with those of the genus Streptomyces. The cell wall of the strain contains LL-diaminopimelic
G P Mueller et al.
The Journal of pharmacology and experimental therapeutics, 290(3), 1331-1336 (1999-08-24)
Peptidylglycine-alpha-hydroxylating monooxygenase (PHM; EC 1.14.17. 3) catalyzes the first and rate-limiting reaction in the two-step process that alpha-amidates neural and endocrine peptides. The substrate analog 4-phenyl-3-butenoic acid (PBA) was shown in vitro to selectively inhibit PHM without affecting the activity
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