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tert-Tetradecanethiol (mixture of isomers) - >97.0%(T), high purity , CAS No.28983-37-1

COA

Grade & Purity:

≥97%(T)

Cas Number: 28983-37-1
Molecular Weight: 230.45
MDL number: MFCD00041145
PubChem CID: 21493711

In stock

Item Number

T162378

Grouped product items
SKU	Size	Availability	Price
T162378-1g	1g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$9.90
T162378-5g	5g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$16.90
T162378-25g	25g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$63.90

View related series

Non heterocyclic block (8163) Sulfur containing compounds (986)

Basic Description

Synonyms	t-tetradecanethiol \| T0083 \| EINECS 249-351-3 \| 2-methyltridecane-2-thiol \| tert-Tetradecyl mercaptan \| tert-Tetradecanethiol \| DTXSID10951599 \| SCHEMBL51185 \| D92300
Specifications & Purity	≥97%(T)
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organosulfur compounds
  - Class Thiols
    - Subclass Alkylthiols

Kingdom	Organic compounds
Superclass	Organosulfur compounds
Class	Thiols
Subclass	Alkylthiols
Intermediate Tree Nodes	Not available
Direct Parent	Alkylthiols
Alternative Parents	Hydrocarbon derivatives
Molecular Framework	Aliphatic acyclic compounds
Substituents	Alkylthiol - Hydrocarbon derivative - Aliphatic acyclic compound
Description	This compound belongs to the class of organic compounds known as alkylthiols. These are organic compounds containing the thiol functional group linked to an alkyl chain.
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	2-methyltridecane-2-thiol
INCHI	InChI=1S/C14H30S/c1-4-5-6-7-8-9-10-11-12-13-14(2,3)15/h15H,4-13H2,1-3H3
InChIKey	LMDDHLWHSDZGIH-UHFFFAOYSA-N
Smiles	CCCCCCCCCCCC(C)(C)S
Isomeric SMILES	CCCCCCCCCCCC(C)(C)S
PubChem CID	21493711
Molecular Weight	230.45
Reaxy-Rn	14855075

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

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

Analytical Chart:

Chemical and Physical Properties

Refractive Index	1.47
Flash Point(°F)	121°C(lit.)
Flash Point(°C)	121°C(lit.)
Molecular Weight	230.460 g/mol
XLogP3	6.700
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	10
Exact Mass	230.207 Da
Monoisotopic Mass	230.207 Da
Topological Polar Surface Area	1.000 Å²
Heavy Atom Count	15
Formal Charge	0
Complexity	129.000
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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