Benzene,(1-bromoethenyl)-

Inquiry

Molecular Formula:

C8H7 Br

Molecular Weight:

183.05

CAS Number:

98-81-7

Catalog Number:

98-81-7

Product Information

Molecular Formula:

C8H7 Br

Molecular Weight:

183.05

Description

Benzene, (1-bromoethenyl)- is an imperative compound in the realm of biomedicine. Within the vast expanse of pharmaceutical research, this compound assumes a pivotal role in the intricate web of drug development aimed at combating a myriad of illnesses, most notably cancer and HIV. Owing to its unmistakable chemical configuration, the profound efficacy of this compound lies in its ability to establish precariously precise associations with distinct cellular receptors, thus facilitating optimal drug administration and augmenting the overall therapeutic aftermath.

Synonyms

BROMOSTYRENE; 1-(1-BROMOVINYL)BENZENE; ALPHA-BROMOSTYRENE; (1-bromoethenyl)-benzen; (1-Bromovinyl)benzene; 1-Bromostyrene; 1-phenylvinylbromide; alpha-bromo-styren

IUPAC Name

1-bromoethenylbenzene

Canonical SMILES

C=C(C1=CC=CC=C1)Br

InChI

InChI=1S/C8H7Br/c1-7(9)8-5-3-2-4-6-8/h2-6H,1H2

InChI Key

SRXJYTZCORKVNA-UHFFFAOYSA-N

Boiling Point

67-70 °C / 4 mmHg

Melting Point

-44 °C

Flash Point

87 °C (C.C)

Purity

95%

Density

1.387g/cm3

Storage

2-8°C

Refractive Index

n20/D 1.588 (lit.)

Safety Information

Hazards

H315 - H319 - H335

Precautionary Statement

P261 - P264 - P271 - P280 - P302 + P352 - P305 + P351 + P338

Computed Properties

XLogP3

3.2

Hydrogen Bond Donor Count

Hydrogen Bond Acceptor Count

Rotatable Bond Count

Exact Mass

181.97311 g/mol

Monoisotopic Mass

181.97311 g/mol

Topological Polar Surface Area

0Å²

Heavy Atom Count

Formal Charge

Complexity

101

Isotope Atom Count

Defined Atom Stereocenter Count

Undefined Atom Stereocenter Count

Defined Bond Stereocenter Count

Undefined Bond Stereocenter Count

Covalently-Bonded Unit Count

Compound Is Canonicalized

Yes

Patents

Publication Number	Title	Priority Date
CN-112795169-A	Resin composition, resin film containing resin composition, prepreg, laminated board, copper-clad plate and printed circuit board	2020-12-31
CN-112574244-A	Synthesis method of 1-phenyl vinyl borate	2020-12-22
WO-2022055086-A1	All-solid-state battery	2020-09-09
WO-2022045003-A1	Resin composition, molded article and cosmetics container	2020-08-28
DE-102020210772-A1	Odor-absorbing active ingredient combination for deodorants	2020-08-26
JP-2022029023-A	Creation of functional composite fine particles using a gradient type polymer surfactant and a liquid drying method in combination	2020-08-04
JP-2022029024-A	Creation of functional composite fine particles using a combination of an end-mixed block-type polymer surfactant and an in-liquid drying method	2020-08-04
JP-2022029025-A	Creation of functional composite fine particles using a polymer surfactant synthesized by precision polymerization and an in-liquid drying method in combination.	2020-08-04
US-2022002459-A1	Multi-Stage Polymer with Low MW Shell and High Tg Core for Early Block Resistance	2020-07-06
CN-111694217-A	Photosensitive resin composition	2020-05-25

Literatures

PMID	Publication Date	Title	Journal
16433529	2006-02-01	In situ generation of vinyl allenes and its applications to one-pot assembly of cyclohexene, cyclooctadiene, 3,7-nonadienone, and bicyclo[6.4.0]dodecene derivatives with palladium-catalyzed multicomponent reactions	Journal of the American Chemical Society
15685588	2005-04-08	Cascade alkenyl amination/Heck reaction promoted by a bifunctional palladium catalyst: a novel one-pot synthesis of indoles from o-haloanilines and alkenyl halides	Chemistry (Weinheim an der Bergstrasse, Germany)

The molarity calculator equation

Mass (g) = Concentration (mol/L) × Volume (L) × Molecular Weight (g/mol)

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The dilution calculator equation

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This equation is commonly abbreviated as: C₁V₁ = C₂V₂

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