Isochroman - ≥98% , CAS No.493-05-0

CAS: 493-05-0 Cat. No.: I122961 Peso molecular: 134.18 Beilstein Registry Number: 17(5)1,595 Número EC: 207-774-0
Disponible para pedir
GRADE & PURITY ≥98%
Synonyms
EINECS 207-774-0 | 3,4-Dihydro-1H-isochromene | Pyridinium, 1-butyl-4-methyl-, chloride | EN300-52549 | NSC63362 | NSC-63362 | 3,4-Dihydro-1H-2-benzopyran; isochromane | 3,4-Dihydro-1H-isochromene # | AKOS009157107 | AM85788 | 1,2,3,4-TETRAHYDROBENZO(C)PY
Storage
Argon charged,Room temperature
Shipped In
Normal
 ·  off list, applied to all prices below.
Size
Estado
Price
Qty
5g
I122961-5g
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.
9,90US$
10g
I122961-10g
9
10,90US$
25g
I122961-25g
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.

13,90US$

20,90US$
Guardar 7,00 US$ (33.49%)
50g
I122961-50g
4

25,90US$

38,90US$
Guardar 13,00 US$ (33.42%)
100g
I122961-100g
1

42,90US$

64,90US$
Guardar 22,00 US$ (33.90%)
500g
I122961-500g
1

182,90US$

274,90US$
Guardar 92,00 US$ (33.47%)
Enter a quantity for the sizes you want to add.
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Why this grade

≥98% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

🌡

Storage & shipping

Argon charged,Room temperature Ships Normal Check lot-specific COA for exact specifications.

📋

Quality documents

SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.

📚

Literature proof

Cited in 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Specifications

Sinónimos
EINECS 207-774-0 | 3, 4-Dihydro-1H-isochromene | Pyridinium, 1-butyl-4-methyl-, chloride | EN300-52549 | NSC63362 | NSC-63362 | 3, 4-Dihydro-1H-2-benzopyran; isochromane | 3, 4-Dihydro-1H-isochromene # | AKOS009157107 | AM85788 | 1, 2, 3, 4-TETRAHYDROBENZO(C)PY
Especificaciones y pureza
≥98%
Condiciones de almacenamiento de almacenamiento
Argon charged, Room temperature
Enviado en
Normal
Pureza
≥98%
Nombres e identificadores
Pubchem Sid488186984
Pubchem Sid Urlhttps://pubchem.ncbi.nlm.nih.gov/substance/488186984
Sonrisas canónicasC1COCC2=CC=CC=C21
IUPAC Name3,4-dihydro-1H-isochromene
InChIKeyHEBMCVBCEDMUOF-UHFFFAOYSA-N
INCHI1S/C9H10O/c1-2-4-9-7-10-6-5-8(9)3-1/h1-4H,5-7H2
Isómeros SMILES C1COCC2=CC=CC=C21
WGK Alemania 3
Peso molecular 134.18
Beilstein 17(5)1,595
Reaxy-Rn 116154
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=116154&ln=

Documentation

📋 Safety Data Sheet (SDS)

Comprehensive hazard, handling, storage, and regulatory compliance document.

Download SDS →

✅ Certificate of Analysis (COA)

Lot-specific quality data. Enter your lot number to retrieve the exact COA.

Look up COA →

📊 Datasheet

Quick-reference summary of product specifications and applications.

View datasheet →

🔬 Specification Sheet

Full quality attributes and acceptance criteria for this grade.

View spec sheet →

Advanced Data

Taxonomic Classification

Taxonomy Tree

KingdomOrganic compounds
SuperclassOrganoheterocyclic compounds
ClaseBenzopyrans
Subclass2-benzopyrans
Intermediate Tree Nodes Not available
Direct Parent2-benzopyrans
Alternative Parents Benzenoids  Oxacyclic compounds  Dialkyl ethers  Hydrocarbon derivatives  
Molecular FrameworkAromatic heteropolycyclic compounds
Substituents 2-benzopyran - Benzenoid - Oxacycle - Ether - Dialkyl ether - Organic oxygen compound - Hydrocarbon derivative - Organooxygen compound - Aromatic heteropolycyclic compound
DescripciónThis compound belongs to the class of organic compounds known as 2-benzopyrans. These are organic aromatic compounds that 1-benzopyran, a bicyclic compound made up of a benzene ring fused to a pyran, so that the oxygen atom is at the 2-position.
External Descriptors isochromanes
Estructura 3D
Modelo de Estructura Química Interactiva





Certificados (CoA, COO, BSE/TSE y tabla de análisis)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:

Find and download the COA for your product by matching the lot number on the packaging.

8 results found

Lot NumberCertificate TypeFechaArticulo
G1415020Certificate of AnalysisFeb 05, 2026 I122961
E23171037Certificate of AnalysisMay 04, 2023 I122961
E23171115Certificate of AnalysisMay 04, 2023 I122961
E23171152Certificate of AnalysisMay 04, 2023 I122961
E2317661Certificate of AnalysisMay 04, 2023 I122961
E2317801Certificate of AnalysisMay 04, 2023 I122961
E2317821Certificate of AnalysisMay 04, 2023 I122961
D2315391Certificate of AnalysisMay 10, 2022 I122961
Propiedades químicas y físicas
SensibilidadAir Sensitive
Índice de refracción1.545
Punto de inflamación (°F)150.8 °F
Punto de inflamación (°C)66°C
Punto de ebullición (°C)110°C/25mmHg
Peso molecular134.170 g/mol
XLogP31.600
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count0
Exact Mass134.073 Da
Monoisotopic Mass134.073 Da
Topological Polar Surface Area9.200 Ų
Heavy Atom Count10
Formal Charge0
Complexity111.000
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
The total count of all stereochemical bonds0
Covalently-Bonded Unit Count1
Preguntas frecuentes y artículos
Calculadoras de soluciones
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