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1-Isopropyl-3-phenylthiourea - 97%, high purity , CAS No.15093-36-4

COA

Grade & Purity:

≥97%

Cas Number: 15093-36-4
Molecular Weight: 194.30
PubChem CID: 2759508

In stock

Item Number

I587356

Grouped product items
SKU	Size	Availability	Price
I587356-1g	1g	3	$40.90
I587356-5g	5g	Available within 4-8 weeks(?) Items will be manufactured post-order and can take 4-8 weeks. Thank you for your patience!	$180.90
I587356-25g	25g	2	$808.90

Basic Description

Synonyms	N-Isopropyl-N'-phenylthiourea # \| N-Isopropyl-N'-phenylthiourea \| 1-iso-propyl-3-phenyl-2-thiourea \| 1-Isopropyl-3-phenyl-2-thiourea \| N-Phenyl-N'-isopropylthiourea \| 1-phenyl-3-propan-2-ylthiourea \| NSC 131983 \| NSC131983 \| NSC-131983 \| DTXSID20164653 \|
Specifications & Purity	≥97%
Storage Temp	Store at 2-8°C,Desiccated
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 N-phenylthioureas

Kingdom	Organic compounds
Superclass	Benzenoids
Class	Benzene and substituted derivatives
Subclass	N-phenylthioureas
Intermediate Tree Nodes	Not available
Direct Parent	N-phenylthioureas
Alternative Parents	Thioureas Organopnictogen compounds Organonitrogen compounds Hydrocarbon derivatives
Molecular Framework	Aromatic homomonocyclic compounds
Substituents	N-phenylthiourea - Thiourea - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Organosulfur compound - Organonitrogen compound - Aromatic homomonocyclic compound
Description	This compound belongs to the class of organic compounds known as n-phenylthioureas. These are compounds containing a N-phenylthiourea moiety, which is structurally characterized by a phenyl group linked to one nitrogen atom of a thiourea group.
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

IUPAC Name	1-phenyl-3-propan-2-ylthiourea
INCHI	InChI=1S/C10H14N2S/c1-8(2)11-10(13)12-9-6-4-3-5-7-9/h3-8H,1-2H3,(H2,11,12,13)
InChIKey	LFBMRUOVWMEFFZ-UHFFFAOYSA-N
Smiles	CC(C)NC(=S)NC1=CC=CC=C1
Isomeric SMILES	CC(C)NC(=S)NC1=CC=CC=C1
Molecular Weight	194.30
Reaxy-Rn	2803981
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2803981&ln=

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

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

Analytical Chart:

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3 results found

Lot Number	Certificate Type	Date	Item
H2309630	Certificate of Analysis	Jul 28, 2023	I587356
H2309623	Certificate of Analysis	Jul 28, 2023	I587356
H2309622	Certificate of Analysis	Jul 28, 2023	I587356

Chemical and Physical Properties

Melt Point(°C)	98-100°
Molecular Weight	194.300 g/mol
XLogP3	2.300
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	2
Exact Mass	194.088 Da
Monoisotopic Mass	194.088 Da
Topological Polar Surface Area	56.200 Å²
Heavy Atom Count	13
Formal Charge	0
Complexity	162.000
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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