2-Bromo-5-methoxybenzaldehyde - ≥97% , CAS No.7507-86-0

CAS: 7507-86-0 Cat. No.: B120909 Formula: C₈H₇BrO₂ Peso molecolare: 215.04 Numero EC: 628-602-4

GRADE & PURITY ≥97%

Synonyms

2-Bromo-5-methoxybenzaldehyde, 97% | 2-bromo-5-methoxylbenzaldehyde | bromo-5-methoxybenzaldehyde | J-508390 | NSC401439 | NSC-401439 | EN300-114568 | AC-23057 | 3-Methoxy-6-bromobenzaldehyde | AM20060263 | Z1079442692 | SCHEMBL584683 | 2-bromo-5-methoxyb

Storage

Store at 2-8°C,Argon charged

Shipped In

Wet ice

Specifications

Sinonimi

2-Bromo-5-methoxybenzaldehyde, 97% | 2-bromo-5-methoxylbenzaldehyde | bromo-5-methoxybenzaldehyde | J-508390 | NSC401439 | NSC-401439 | EN300-114568 | AC-23057 | 3-Methoxy-6-bromobenzaldehyde | AM20060263 | Z1079442692 | SCHEMBL584683 | 2-bromo-5-methoxyb

Specifiche e purezza

≥97%

Condizioni di conservazione di stoccaggio

Store at 2-8°C,Argon charged

Spedito in

Wet ice

Questo prodotto richiede spedizione a catena fredda. I servizi di terra e altri servizi economici non sono disponibili.

Purezza

≥97%

Nomi e identificatori

Pubchem Sid

504758524

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/504758524

Sorrisi canonici

COC1=CC(=C(C=C1)Br)C=O

IUPAC Name

2-bromo-5-methoxybenzaldehyde

InChIKey

XNHKTMIWQCNZST-UHFFFAOYSA-N

INCHI

1S/C8H7BrO2/c1-11-7-2-3-8(9)6(4-7)5-10/h2-5H,1H3

Isomeri SMILES

COC1=CC(=C(C=C1)Br)C=O

WGK Germania

3

Peso molecolare

215.04

Reaxy-Rn

2246539

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2246539&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Classe Benzene and substituted derivatives
      • Subclass Benzoyl derivatives

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Classe: Benzene and substituted derivatives
• Subclass: Benzoyl derivatives
• Intermediate Tree Nodes: Not available
• Direct Parent: Benzoyl derivatives
• Alternative Parents: Phenoxy compounds Methoxybenzenes Benzaldehydes Anisoles Bromobenzenes Alkyl aryl ethers Aryl bromides Vinylogous halides Organobromides Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Phenoxy compound - Anisole - Methoxybenzene - Phenol ether - Benzaldehyde - Benzoyl - Alkyl aryl ether - Aryl-aldehyde - Bromobenzene - Halobenzene - Aryl bromide - Aryl halide - Vinylogous halide - Ether - Organohalogen compound - Organobromide - Organooxygen compound - Aldehyde - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Aromatic homomonocyclic compound
• Descrizione: This compound belongs to the class of organic compounds known as benzoyl derivatives. These are organic compounds containing an acyl moiety of benzoic acid with the formula (C6H5CO-).
• External Descriptors: Not available

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.

DOI: 10.1186/s13321-016-0174-y

Proprietà chimiche e fisiche

• Sensibilità: Air Sensitive
• Punto di fusione (°C): 71-76°C
• Peso molecolare: 215.040 g/mol
• XLogP3: 2.000
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 213.963 Da
• Monoisotopic Mass: 213.963 Da
• Topological Polar Surface Area: 26.300 Ų
• Heavy Atom Count: 11
• Formal Charge: 0
• Complexity: 138.000
• 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

Domande frequenti

What is the purity of this product?

This product is supplied at ≥97% purity (chemical assay). Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store at 2–8 °C under argon. It is supplied under an argon blanket; reseal under inert gas after each use.

How is this product shipped?

This product ships chilled on wet ice. Unpack on arrival and transfer it to the storage condition stated above.

What are the CAS number, molecular formula and molecular weight?

The CAS Number is 7507-86-0, the molecular formula is C8H7BrO2, and the molecular weight is 215.04 g/mol. InChIKey XNHKTMIWQCNZST-UHFFFAOYSA-N.

What documentation is provided?

Available product documentation, including Certificates of Analysis (COA), Safety Data Sheets (SDS), and specification sheets, is shown in the product document area. Document availability and access follow the current site policy.