Name: Name:Butyl isothiocyanate
Brand: AABLOCKS
SKU: AA003OJ7
Rating: 90 (10 reviews)

Catalog No.: AA003OJ7

592-82-5 | Butyl isothiocyanate

Pack Size： 1g

Purity： 95%

in stock

$18.00 $13.00

Pack Size： 5g

Purity： 95%

in stock

$67.00 $47.00

Pack Size： 25g

Purity： 95

in stock

$78.00 $55.00

Pack Size： 100g

Purity： 95

in stock

$126.00 $88.00

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Technical Information

Catalog Number: AA003OJ7

Chemical Name: Butyl isothiocyanate

CAS Number: 592-82-5

Molecular Formula: C5H9NS

Molecular Weight: 115.1967

MDL Number: MFCD00004824

SMILES: CCCCN=C=S

NSC Number: 194808

FEMA Number: 4082

Properties

BP: 168.0°C

Form: Liquid

Storage: Room Temperature;Inert atmosphere;

Complexity: 74.1

Covalently-Bonded Unit Count: 1

Defined Atom Stereocenter Count: 0

Defined Bond Stereocenter Count: 0

Formal Charge: 0

Heavy Atom Count: 7

Hydrogen Bond Acceptor Count: 2

Hydrogen Bond Donor Count: 0

Isotope Atom Count: 0

Rotatable Bond Count: 3

Undefined Atom Stereocenter Count: 0

Undefined Bond Stereocenter Count: 0

XLogP3: 2.9

Literature fold

Title: Allyl isothiocyanate as a potential inducer of paraoxonase-1--studies in cultured hepatocytes and in mice.

Journal: IUBMB life20120201

Title: Synthesis and antiproliferative activity of novel α- and β-dialkoxyphosphoryl isothiocyanates.

Journal: Bioorganic & medicinal chemistry letters20110801

Title: In vitro and in vivo antifungal activity of synthetic pure isothiocyanates against Sclerotinia sclerotiorum.

Journal: Pest management science20110701

Title: Allyl-, butyl- and phenylethyl-isothiocyanate activate Nrf2 in cultured fibroblasts.

Journal: Pharmacological research20110301

Title: Extraction and identification of isothiocyanates from broccolini seeds.

Journal: Natural product communications20110101

Title: Semiquantitative analysis of 3-butenyl isothiocyanate to monitor an off-flavor in mustard seeds and glycosinolates screening for origin identification.

Journal: Journal of agricultural and food chemistry20100324

Title: Chemical Investigation of Some Capparis Species Growing in Egypt and their Antioxidant Activity.

Journal: Evidence-based complementary and alternative medicine : eCAM20070901

Title: Spectral studies of tert-butyl isothiocyanate-inactivated P450 2E1.

Journal: Biochemistry20010619

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