tert-Nonyl mercaptan

Product Information

Molecular Formula:
C9H20S
Molecular Weight:
160.32
Description
Polymerization modifier: crosslinking agent, chain transfer agent
Synonyms
1,1-Dimethylheptyl hydrosulfide; tert-nonylmercaptan,mixtureofisomers; T-NONYL MERCAPTAN; TERT-NONANETHIOL; TERT-NONYL MERCAPTAN; 1,1-dimethylheptanethiol
IUPAC Name
2-methyloctane-2-thiol
Canonical SMILES
CCCCCCC(C)(C)S
InChI
InChI=1S/C9H20S/c1-4-5-6-7-8-9(2,3)10/h10H,4-8H2,1-3H3
InChI Key
MPBLPZLNKKGCGP-UHFFFAOYSA-N
Boiling Point
188°C
Flash Point
40 °C(104.0 °F)
Purity
98%
Density
0.856
Appearance
clear liquid
Refractive Index
1.457 (lit.)

Safety Information

Hazards
H226 - H317 - H319 - H335
Precautionary Statement
P210 - P280 - P302 + P352 - P305 + P351 + P338
Signal Word
Warning

Computed Properties

XLogP3
4
Hydrogen Bond Donor Count
1
Hydrogen Bond Acceptor Count
1
Rotatable Bond Count
5
Exact Mass
160.12857181 g/mol
Monoisotopic Mass
160.12857181 g/mol
Topological Polar Surface Area
1Ų
Heavy Atom Count
10
Formal Charge
0
Complexity
76.8
Isotope Atom Count
0
Defined Atom Stereocenter Count
0
Undefined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
0
Undefined Bond Stereocenter Count
0
Covalently-Bonded Unit Count
1
Compound Is Canonicalized
Yes

Patents

Publication Number Title Priority Date
CN-112521999-A Lubricating oil metal deactivator mixture and preparation method thereof 2020-12-14
US-11169461-B1 Toner surface additive 2020-09-24
EP-3957659-A1 Functionalized polymers 2020-08-19
WO-2022038054-A1 Functionalized polymers 2020-08-19
CN-111689856-A Preparation method of hindered phenol antioxidant and intermediate thereof 2020-07-17
EP-3915543-A1 Solid self-nanoemulsifying drug delivery system (s-snedds) 2020-05-28
EP-3916029-A1 Novel methacrylate copolymer and compositions comprising it 2020-05-28
WO-2021239787-A1 Novel methacrylate copolymer and compositions comprising it 2020-05-28
WO-2021239798-A1 Solid self-nanoemulsifying drug delivery system (s-snedds) 2020-05-28
WO-2021192507-A1 Acrylic polymer, curable composition, and cured product thereof 2020-03-23

Literatures

PMID Publication Date Title Journal
21125095 2011-01-28 Efficiency enhancement of methanol/ethanol oxidation reactions on Pt nanoparticles prepared using a new surfactant, 1,1-dimethyl heptanethiol Physical chemistry chemical physics : PCCP
The molarity calculator equation

Mass (g) = Concentration (mol/L) × Volume (L) × Molecular Weight (g/mol)

The dilution calculator equation

Concentration (start) × Volume (start) = Concentration (final) × Volume (final)

This equation is commonly abbreviated as: C1V1 = C2V2

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