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Hexylthiourea - 95%, high purity , CAS No.21071-27-2

COA

Grade & Purity:

≥95%

Cas Number: 21071-27-2
Molecular Weight: 160.3
PubChem CID: 1810295

In stock

Item Number

H182731

Grouped product items
SKU	Size	Availability	Price	Qty
H182731-1g	1g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$23.90
H182731-5g	5g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$78.90

Discover Hexylthiourea by Aladdin Scientific in 95% for only $23.90. Available - in Ligands at Aladdin Scientific. Tags: .

Basic Description

Synonyms	1-Hexyl-2-thiourea \| hexylthiourea \| 21071-27-2 \| 1-hexylthiourea \| n-Hexylthiourea \| Thiourea, N-hexyl- \| N-(n-Hexyl)thiourea \| SCHEMBL5531372 \| DTXSID90365236 \| LMYQWQCDUHNQLF-UHFFFAOYSA-N \| STR08015 \| MFCD00041198 \| AKOS001058645 \| NCGC00342608-01 \| CS-0186345 \| FT-0638084 \| EN300-09
Specifications & Purity	≥95%
Storage Temp	Room temperature
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organosulfur compounds
  - Class Thioureas

Kingdom	Organic compounds
Superclass	Organosulfur compounds
Class	Thioureas
Subclass	Not available
Intermediate Tree Nodes	Not available
Direct Parent	Thioureas
Alternative Parents	Organopnictogen compounds Organonitrogen compounds Hydrocarbon derivatives
Molecular Framework	Aliphatic acyclic compounds
Substituents	Thiourea - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Organonitrogen compound - Aliphatic acyclic compound
Description	This compound belongs to the class of organic compounds known as thioureas. These are organic compounds containing the thiourea functional group, a derivative of urea with the general structure (R1(N)R2C(=S)(R3)R4, R1-R4=H, alkyl, aryl), obtained by replacing the carbonyl group of urea with a thiocarbonyl 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	hexylthiourea
INCHI	InChI=1S/C7H16N2S/c1-2-3-4-5-6-9-7(8)10/h2-6H2,1H3,(H3,8,9,10)
InChIKey	LMYQWQCDUHNQLF-UHFFFAOYSA-N
Smiles	CCCCCCNC(=S)N
Isomeric SMILES	CCCCCCNC(=S)N
Molecular Weight	160.3
Reaxy-Rn	1752337
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1752337&ln=

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

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

Analytical Chart:

Chemical and Physical Properties

Molecular Weight	160.280 g/mol
XLogP3	1.900
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	5
Exact Mass	160.103 Da
Monoisotopic Mass	160.103 Da
Topological Polar Surface Area	70.100 Å²
Heavy Atom Count	10
Formal Charge	0
Complexity	93.600
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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