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tert-Butyl isothiocyanate - 99%, high purity , CAS No.590-42-1

≥99%

CAS#: 590-42-1
Formula: C₅H₉NS
Molecular Weight: 115.2
EC Number: 209-682-6
MDL number: MFCD00004816
PubChem CID: 11544

Item Number

B101363

Grouped product items
SKU	Size	Availability	Price
B101363-5g	5g	Available within 4-8 weeks(?) Items will be manufactured post-order and can take 4-8 weeks. Thank you for your patience!	$44.90
B101363-25g	25g	Available within 4-8 weeks(?) Items will be manufactured post-order and can take 4-8 weeks. Thank you for your patience!	$134.90
B101363-100g	100g	Available within 4-8 weeks(?) Items will be manufactured post-order and can take 4-8 weeks. Thank you for your patience!	$485.90

Basic Description

Synonyms	tert-Butyl isothiocyanate \| 590-42-1 \| 2-Isothiocyanato-2-methylpropane \| t-Butyl isothiocyanate \| Propane, 2-isothiocyanato-2-methyl- \| tert-butylisothiocyanate \| tert.-Butyl Isothiocyanate \| 2-isothiocyanato-2-methyl-propane \| 1,1-Dimethylethyl isothiocyanate; tert-But
Specifications & Purity	≥99%
Storage Temp	Store at 2-8°C,Argon charged
Shipped In	Wet ice
Product Description	Product Description Adsorption of tert-butyl isothiocyanate at the Ge (100) surface was studied using multiple internal reflection FTIR spectroscopy, X-ray photoelectron spectroscopy and density functional theory modeling. Product Application tert-Butyl isothiocyanate has been used to modify the pore size of top layer of heterostructured surface mounted metal-organic frameworks.

Associated Targets(Human)

CYP2E1 Tchem Cytochrome P450 2E1 (0 Activities)

Discover Target: CYP2E1

Activity Type	Activity Value -log(M)	Mechanism of Action	Activity Reference	Publications (PubMed IDs)

CYP2E1 Tchem Cytochrome P450 2E1 (2174 Activities)

Discover Target: CYP2E1

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

IUPAC Name

2-isothiocyanato-2-methylpropane

INCHI

InChI=1S/C5H9NS/c1-5(2,3)6-4-7/h1-3H3

InChi Key

ZFWFRTVIIMTOLY-UHFFFAOYSA-N

Canonical SMILES

CC(C)(C)N=C=S

Isomeric SMILES

CC(C)(C)N=C=S

WGK Germany

PubChem CID

11544

UN Number

2929

Packing Group

Molecular Weight

115.2

Certificates

Certificate of Analysis(COA)

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4 results found

Lot Number	Certificate Type	Date	Item
F2210632	Certificate of Analysis	May 23, 2022	B101363
F2210634	Certificate of Analysis	May 23, 2022	B101363
F2210635	Certificate of Analysis	May 23, 2022	B101363
B2225482	Certificate of Analysis	Oct 12, 2021	B101363

Sensitivity

Moisture &heat sensitive.

Refractive Index

1.4810

Flash Point(°F)

100.4 °F

Flash Point(°C)

38 °C

Boil Point(°C)

141~145℃

Melt Point(°C)

10~12°C

Safety and Hazards(GHS)

Pictogram(s)	GHS06, GHS07, GHS02
Signal	Danger
Hazard Statements	H319:Causes serious eye irritation H335:May cause respiratory irritation H301:Toxic if swallowed H311:Toxic in contact with skin H331:Toxic if inhaled H226:Flammable liquid and vapor
Precautionary Statements	P261:Avoid breathing dust/fume/gas/mist/vapors/spray. P305+P351+P338:IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses if present and easy to do - continue rinsing. P280:Wear protective gloves/protective clothing/eye protection/face protection. P370+P378:In case of fire: Use ... to extinguish. P210:Keep away from heat, hot surface, sparks, open flames and other ignition sources. - No smoking. P302+P352:IF ON SKIN: wash with plenty of water. P321:Specific treatment (see ... on this label). P405:Store locked up. P501:Dispose of contents/container to ... P233:Keep container tightly closed. P240:Ground/bond container and receiving equipment. P264:Wash hands [and …] thoroughly after handling. P403+P235:Store in a well-ventilated place. Keep cool. P303+P361+P353:IF ON SKIN (or hair): Take off Immediately all contaminated clothing. Rinse SKIN with water [or shower]. P271:Use only outdoors or in a well-ventilated area. P241:Use explosion-proof [electrical/ventilating/lighting/.../] equipment. P270:Do not eat, drink or smoke when using this product. P304+P340:IF INHALED: Remove person to fresh air and keep comfortable for breathing. P403+P233:Store in a well-ventilated place. Keep container tightly closed. P330:Rinse mouth. P242:Use only non-sparking tools. P243:Take precautionary measures against static discharge. P361+P364:Take off immediately all contaminated clothing and wash it before reuse. P264+P265:Wash hands [and …] thoroughly after handling. Do not touch eyes. P301+P316:IF SWALLOWED: Get emergency medical help immediately. P337+P317:If eye irritation persists: Get medical help. P316:Get emergency medical help immediately. P319:Get medical help if you feel unwell.
WGK Germany	3
Class	6.1 (3)

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tert-Butyl isothiocyanate - 99%, high purity , CAS No.590-42-1

Basic Description

Associated Targets(Human)

Names and Identifiers

Certificates

Certificate of Analysis(COA)

Chemical and Physical Properties

Safety and Hazards(GHS)

Related Documents

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