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3-Vinylbicyclo[4.2.0]octa-1,3,5-triene - 98%, high purity , CAS No.99717-87-0

COA

Grade & Purity:

≥98%

Cas Number: 99717-87-0
Molecular Weight: 130.19
PubChem CID: 22172249
PubChem SID: 504769159

In stock

Item Number

V196176

Grouped product items
SKU	Size	Availability	Price
V196176-50mg	50mg	3	$19.90
V196176-100mg	100mg	3	$30.90
V196176-250mg	250mg	3	$57.90
V196176-1g	1g	3	$177.90
V196176-5g	5g	3	$799.90
V196176-25g	25g	2	$3,597.90

Basic Description

Synonyms	99717-87-0 \| 3-Vinylbicyclo[4.2.0]octa-1,3,5-triene \| 4-vinylbenzocyclobutene \| Bicyclo[4.2.0]octa-1,3,5-triene, 3-ethenyl- \| 3-ethenylbicyclo[4.2.0]octa-1(6),2,4-triene \| MFCD09834065 \| 4-VINYL-BENZOCYCLOBUTANE \| 4-Vinylbenzocyclobutene, 97% \| BCP20396 \| ZDA71787 \| AC-822 \| A
Specifications & Purity	≥98%
Storage Temp	Store at 2-8°C,Argon charged
Shipped In	Wet ice This product requires cold chain shipping. Ground and other economy services are not available.

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Benzenoids
  - Class Benzene and substituted derivatives
    - Subclass Styrenes

Kingdom	Organic compounds
Superclass	Benzenoids
Class	Benzene and substituted derivatives
Subclass	Styrenes
Intermediate Tree Nodes	Not available
Direct Parent	Styrenes
Alternative Parents	Aromatic hydrocarbons Polycyclic hydrocarbons Cyclic olefins
Molecular Framework	Aromatic homopolycyclic compounds
Substituents	Styrene - Aromatic hydrocarbon - Polycyclic hydrocarbon - Cyclic olefin - Unsaturated hydrocarbon - Olefin - Hydrocarbon - Aromatic homopolycyclic compound
Description	This compound belongs to the class of organic compounds known as styrenes. These are organic compounds containing an ethenylbenzene moiety.
External Descriptors	Not available
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

Names and Identifiers

Pubchem Sid	504769159
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/504769159
IUPAC Name	3-ethenylbicyclo[4.2.0]octa-1(6),2,4-triene
INCHI	InChI=1S/C10H10/c1-2-8-3-4-9-5-6-10(9)7-8/h2-4,7H,1,5-6H2
InChIKey	DTGDMPJDZKDHEP-UHFFFAOYSA-N
Smiles	C=CC1=CC2=C(CC2)C=C1
Isomeric SMILES	C=CC1=CC2=C(CC2)C=C1
PubChem CID	22172249
Molecular Weight	130.19

Certificates（CoA,COO,BSE/TSE and Analysis Chart)

C of A & Other Certificates(BSE/TSE, COO):

Analytical Chart:

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6 results found

Lot Number	Certificate Type	Date	Item
C2310152	Certificate of Analysis	Dec 12, 2022	V196176
C2310498	Certificate of Analysis	Dec 12, 2022	V196176
C2310473	Certificate of Analysis	Dec 12, 2022	V196176
C2310505	Certificate of Analysis	Dec 12, 2022	V196176
C2310500	Certificate of Analysis	Dec 12, 2022	V196176
C2310502	Certificate of Analysis	Dec 12, 2022	V196176

Chemical and Physical Properties

Refractive Index	1.578
Molecular Weight	130.190 g/mol
XLogP3	2.100
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	0
Rotatable Bond Count	1
Exact Mass	130.078 Da
Monoisotopic Mass	130.078 Da
Topological Polar Surface Area	0.000 Å²
Heavy Atom Count	10
Formal Charge	0
Complexity	137.000
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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