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· · COA & SDS Disponibile per ogni prodotto · Spedizione lo stesso giorno su articoli in magazzino Phthalide - ≥99% , CAS No.87-41-2
Synonyms
PHTHALIDE|1-Phthalanone|1-Isobenzofuranone|Isobenzofuran-1(3H)-one|Phthalolactone|2-Hydroxymethylbenzoic acid, gamma-lactone|1(3H)-Isobenzofuranone|CHLORTALIDONE IMPURITY 7|2-Hydroxymethylbenzoic acid, laquo gammaRaquo -lactone|3H-isobenzofuran-1-one|(3H)-isobenzofuranone|1,3-Dihydrobenzo[C]furan-2-one;2-Benzofuran-1(3H)-one;2-Hydroxymethylbenzoic acid, gamma-lactone;Phthalolactone|isobenzofuran-1-one|1,3-dihydro-2-benzofuran-1-one|1H-Isobenzofuran-3-one|2-Benzofuran-1(3H)-one #|isobenzofuran-1 (3H)-one|Isobenzofuranone|PHTHALIDE [FHFI]|2-Hydroxymethylbenzoic acid, .gamma.-lactone|Phthalanone|3-oxo-1,3-dihydro-isobenzofuran|Butylphthalide Impurity 4|2-Benzofuran-1(3H)-one|1(3H)-Isobenzofuranone-1-11C
Storage
Argon charged,Room temperature
Specifiche Sinonimi
PHTHALIDE | 1-Phthalanone | 1-Isobenzofuranone | Isobenzofuran-1(3H)-one | Phthalolactone | 2-Hydroxymethylbenzoic acid, gamma-lactone | 1(3H)-Isobenzofuranone | CHLORTALIDONE IMPURITY 7 | 2-Hydroxymethylbenzoic acid, laquo gammaRaquo -lactone | 3H-isobenzofuran-1-one | (3H)-isobenzofuranone | 1,3-Dihydrobenzo[C]furan-2-one;2-Benzofuran-1 Mostra altro
Condizioni di conservazione di stoccaggio
Argon charged,Room temperature
Nomi e identificatori Pubchem Sid Url
https://pubchem.ncbi.nlm.nih.gov/substance/488180189
Sorrisi canonici
C1C2=CC=CC=C2C(=O)O1
IUPAC Name
3H-2-benzofuran-1-one
InChIKey
WNZQDUSMALZDQF-UHFFFAOYSA-N
INCHI
1S/C8H6O2/c9-8-7-4-2-1-3-6(7)5-10-8/h1-4H,5H2
Isomeri SMILES
C1C2=CC=CC=C2C(=O)O1
Reaxys-RN_link_address
https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=114632&ln=
Dati avanzati Taxonomic Classification Kingdom Organic compounds Superclass Organoheterocyclic compounds Classe Isocoumarans Subclass Isobenzofuranones Intermediate Tree Nodes Not available Direct Parent Phthalides Alternative Parents Benzenoids Lactones Carboxylic acid esters Oxacyclic compounds Monocarboxylic acids and derivatives Organooxygen compounds Organic oxides Hydrocarbon derivatives Molecular Framework Aromatic heteropolycyclic compounds Substituents Phthalide - Benzenoid - Lactone - Carboxylic acid ester - Oxacycle - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Aromatic heteropolycyclic compound Descrizione This compound belongs to the class of organic compounds known as phthalides. These are compounds containing a 3-hydrocarbylidene-2-benzofuran-1(3H)-one moiety,. External Descriptors 2-benzofurans - gamma-lactone Data sources 1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.
Struttura 3D Obiettivi associati (umani) Meccanismi d'azione Certificati (CoA, COO, BSE/TSE e tabella di analisi) Proprietà chimiche e fisiche Sensibilità Moisture & light sensitive Indice di rifrazione 1.536 Punto di infiammabilità (°F) 305.6 °F Punto di infiammabilità (°C) 152℃ Punto di ebollizione (°C) 290°C Punto di fusione (°C) 70-73°C Peso molecolare 134.130 g/mol XLogP3 0.800 Hydrogen Bond Donor Count 0 Hydrogen Bond Acceptor Count 2 Rotatable Bond Count 0 Exact Mass 134.037 Da Monoisotopic Mass 134.037 Da Topological Polar Surface Area 26.300 Ų Heavy Atom Count 10 Formal Charge 0 Complexity 153.000 Isotope Atom Count 0 Defined Atom Stereocenter Count 0 Undefined Atom Stereocenter Count 0 Defined Bond Stereocenter Count 0 Undefined Bond Stereocenter Count 0 The total count of all stereochemical bonds 0 Covalently-Bonded Unit Count 1
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Reconstitution Calculator Recensioni Prodotti correlati phthalide-6-carboxylic acid - ≥97% , CAS No.4743-61-7
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6-AMINOPHTHALIDE - ≥95% , CAS No.57319-65-0
6-Nitrophthalide - ≥95% , CAS No.610-93-5
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5-Cyanophthalide - ≥97% , CAS No.82104-74-3
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3-Phenylphthalide - ≥98% , CAS No.5398-11-8
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3-(1,2-Dimethyl-3-indolyl)-3-[4-(diethylamino)-2-methylphenyl]phthalide - ≥98% , CAS No.36499-49-7
3-Bromophthalide - ≥95%(GC) , CAS No.6940-49-4
3-Butylidenephthalide - 10mM in DMSO , CAS No.551-08-6
4-Aminophthalide - ≥98% , CAS No.59434-19-4
Butylphthalide - Moligand™,≥98% , CAS No.6066-49-5
Butylphthalide - Moligand™,10mM in DMSO , CAS No.6066-49-5
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