ChemicalBook--->CAS DataBase List--->13173-09-6

13173-09-6

13173-09-6 Structure

13173-09-6 Structure
IdentificationBack Directory
[Name]

(+/-)-cis-Bicyclo[3.2.0]hept-2-en-6-one
[CAS]

13173-09-6
[Synonyms]

Bicyclohepten
BICYCLO[3.2.0]HEPT-2-EN-6-ONE
bicyclo[3.2.0]hept-3-en-7-one
Bicyclo(3.2.0)hept-2-en-6-one,96%
Bicyclo3.2.0ühept-2-en-6-one, 97%
(+/-)-cis-Bicyclo[3.2.0]hept-2-en-6-one
Bicyclo[3.2.0]hept-2-en-6-one bisulphite adduct
(+/-)-cis-Bicyclo[3.2.0]hept-2-en-6-one >=98.0%
low price (+/-)-cis-Bicyclo[3.2.0]hept-2-en-6-one
(±)-cis-Bicyclo[3.2.0]hept-2-en-6-one
[Molecular Formula]

C7H8O
[MDL Number]

MFCD00066201
[MOL File]

13173-09-6.mol
[Molecular Weight]

108.14
Chemical PropertiesBack Directory
[Boiling point ]

158-160 °C(lit.)
[density ]

1.025 g/mL at 25 °C(lit.)
[refractive index ]

n20/D 1.4820(lit.)
[storage temp. ]

under inert gas (nitrogen or Argon) at 2-8°C
[Appearance]

Colorless to light yellow Liquid
[Sensitive ]

Air Sensitive
[InChI]

InChI=1S/C7H8O/c8-7-4-5-2-1-3-6(5)7/h1-2,5-6H,3-4H2
[InChIKey]

LNLLHUHPGPKRBM-UHFFFAOYSA-N
[SMILES]

C12C(C(=O)C1)CC=C2
Safety DataBack Directory
[Hazard Codes ]

Xn
[Risk Statements ]

22-37/38-41
[Safety Statements ]

26-39
[RIDADR ]

UN1224
[WGK Germany ]

3
[F ]

10-23
[HazardClass ]

3
[PackingGroup ]

III
[HS Code ]

29337900
[Storage Class]

10 - Combustible liquids
[Hazard Classifications]

Acute Tox. 4 Oral
Eye Dam. 1
Skin Irrit. 2
STOT SE 3
Hazard InformationBack Directory
[Uses]

Bicyclo[3.2.0]hept-2-en-6-one is widely utilized to study enantioselective Baeyer-Villiger oxidation of (±)-cis-bicyclo(3.2.0)hept-2-en-6-one. It is used in the synthesis of a series of chalcone derivatives by reacting with arylaldehydes. It is also used to analyze the extremophile enzymes (monooxygenase and hydrolases) in microorganisms which are isolated from a deep-water petroleum reservoir and at high temperatures using fluorogenic assays and multibioreactions.
[General Description]

(±)-cis-bicyclo(3.2.0)hept-2-en-6-one undergoes preparative scale Baeyer–Villiger biooxidation at high concentration using recombinant Escherichia coli biocatalyst and adsorbent resin (in situ substrate feeding and product removal).
Spectrum DetailBack Directory
[Spectrum Detail]

(+/-)-cis-Bicyclo[3.2.0]hept-2-en-6-one(13173-09-6)1HNMR
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