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5-(BROMOMETHYL)THIOPHENE-2-CARBONITRILE

5-(BROMOMETHYL)THIOPHENE-2-CARBONITRILE structure

CAS No:
134135-41-4
Formula:
C6H4BrNS
Chemical Name:
5-(BROMOMETHYL)THIOPHENE-2-CARBONITRILE
Synonyms:
5-(bromomethyl)thiophene-2-carbonitrile;2-Thiophenecarbonitrile, 5-(bromomethyl)-;ACMC-1BYIH;3-phenylpropylboronic?acid;SCHEMBL1482051;CTK0G9999;KS-00000EZD;DTXSID10441723;2-cyano-5-(bromomethyl)thiophene;5-bromomethylthiophene-2-carbonitrile
Categories:
Chemical Reagents > Organic Reagents

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5-(BROMOMETHYL)THIOPHENE-2-CARBONITRILE Basic Attributes

Molecular Weight：

202.07

Exact Mass：

200.924774

DSSTox ID：

DTXSID10441723

HScode：

2934999090

Characteristics

PSA：

XLogP3：

2.2

Density：

1.7±0.1 g/cm3

Flash Point：

121.3±23.2 °C

Refractive Index：

1.616

Safety Information

GHS Classification：

|Danger|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P260, P261, P264, P270, P271, P280, P301+P312, P301+P330+P331, P302+P352, P303+P361+P353, P304+P312, P304+P340, P305+P351+P338, P310, P312, P321, P322, P330, P363, P405, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

5-(BROMOMETHYL)THIOPHENE-2-CARBONITRILE Use and Manufacturing

A mixture of 5-methylthiophene-2-carbonitrile (9.9 g, 80.5 mmol), benzoylperoxide (0.23 g, 0.95 mmol), and N-bromosuccinimide (15 g, 84.3 mmol) in carbontetrachloride (200 mL) was heated at reflux for 6 h. The resulting suspension was filtered and the filtrate diluted with dichloromethane (400 mL), washed with a saturated sodium bicarbonate solution, dried over magnesium sulfate, and concentrated in vacuo. The residue was purified by column chromatography (EtOAc n-hexane, 1:4) to give the title compound as a yellow oil (14.0 g, 86percent).1H NMR (CDCl3) 7.50 (d, 1H), 7.13 (d, 1H), 4.68 (s, 2H).???FAB MS 203 [M+1]+Example 24 Example 78 A C) C) C) C)

Computed Properties

Molecular Weight:202.07
XLogP3:2.2
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:200.92478
Monoisotopic Mass:200.92478
Topological Polar Surface Area:52
Heavy Atom Count:9
Complexity:139
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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5-(Bromomethyl)thiophene-2-carbonitrile

CAS No.: 134135-41-4

Content: 99.00%

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Compound Net Biotechnology Inc. Contact Supplier

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Manufactory Supplier of 4-(Pentafluorothio)aniline,Pentafluoro,Pentafluorothio,Pentafluorosulfur,[4-(bromomethyl)phenyl]-pentafluoro-lambda6-sulfane,[4-(pentafluoro-sulfanyl)phenyl]acetic acid

134135-41-4 5-(bromomethyl)thiophene-2-carbonitrile

CAS No.: 134135-41-4

Grade: Industrial Grade

Content: 95%

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Guide of 5-(BROMOMETHYL)THIOPHENE-2-CARBONITRILE

Basic Attributes
Characteristics
Safety Information
Use and Manufacturing
Computed Properties
Recommended Suppliers
Latest News
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5-(BROMOMETHYL)THIOPHENE-2-CARBONITRILE

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