Heptyl Sulfide - ≥97%(GC) , CAS No.629-65-2

CAS: 629-65-2 Cat. No.: H157106 Molecular Weight: 230.45 EC Number: 211-101-6
AVAILABLE TO ORDER
GRADE & PURITY ≥97%(GC)
Synonyms
Heptane, 1,1'-thiobis- | G6CCC2QR5A | LEMIDOZYVQXGLI-UHFFFAOYSA-N | di-n-Heptyl sulfide | AKOS015897604 | D90850 | Heptyl sulfide | SCHEMBL460167 | FT-0624937 | Diheptyl sulfide | Acrylic acid, 2,3-diphenyl- | 1-(Heptylsulfanyl)heptane | diheptylsulfane |
Storage
Argon charged,Room temperature
Shipped In
Normal
 ·  off list, applied to all prices below.
Size
Status
Price
Qty
1g
H157106-1g
2
$39.90
5g
H157106-5g
2
$121.90
25g
H157106-25g
1
$396.90
Enter a quantity for the sizes you want to add.
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Why this grade

≥97%(GC) for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

🌡

Storage & shipping

Argon charged,Room temperature Ships Normal Check lot-specific COA for exact specifications.

📋

Quality documents

SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.

📚

Literature proof

Cited in 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Specifications

Synonyms
Heptane, 1, 1'-thiobis- | G6CCC2QR5A | LEMIDOZYVQXGLI-UHFFFAOYSA-N | di-n-Heptyl sulfide | AKOS015897604 | D90850 | Heptyl sulfide | SCHEMBL460167 | FT-0624937 | Diheptyl sulfide | Acrylic acid, 2, 3-diphenyl- | 1-(Heptylsulfanyl)heptane | diheptylsulfane |
Specifications & Purity
≥97%(GC)
Storage
Argon charged, Room temperature
Shipped In
Normal
Purity
≥97%(GC)
Names and Identifiers
Pubchem Sid504754388
Pubchem Sid Urlhttps://pubchem.ncbi.nlm.nih.gov/substance/504754388
Canonical SmilesCCCCCCCSCCCCCCC
IUPAC Name1-heptylsulfanylheptane
InChIKeyLEMIDOZYVQXGLI-UHFFFAOYSA-N
INCHI1S/C14H30S/c1-3-5-7-9-11-13-15-14-12-10-8-6-4-2/h3-14H2,1-2H3
Isomeric SMILES CCCCCCCSCCCCCCC
Molecular Weight 230.45
Reaxy-Rn 1742679
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1742679&ln=

Documentation

📋 Safety Data Sheet (SDS)

Comprehensive hazard, handling, storage, and regulatory compliance document.

Download SDS →

✅ Certificate of Analysis (COA)

Lot-specific quality data. Enter your lot number to retrieve the exact COA.

Look up COA →

📊 Datasheet

Quick-reference summary of product specifications and applications.

View datasheet →

🔬 Specification Sheet

Full quality attributes and acceptance criteria for this grade.

View spec sheet →

Advanced Data

Taxonomic Classification

Taxonomy Tree

KingdomOrganic compounds
SuperclassOrganosulfur compounds
ClassThioethers
SubclassDialkylthioethers
Intermediate Tree Nodes Not available
Direct ParentDialkylthioethers
Alternative Parents Sulfenyl compounds  Hydrocarbon derivatives  
Molecular FrameworkAliphatic acyclic compounds
Substituents Dialkylthioether - Sulfenyl compound - Hydrocarbon derivative - Aliphatic acyclic compound
DescriptionThis compound belongs to the class of organic compounds known as dialkylthioethers. These are organosulfur compounds containing a thioether group that is substituted by two alkyl groups.
External Descriptors Not available
3D Structure
Interactive Chemical Structure Model





Certificates(CoA,COO,BSE/TSE and Analysis Chart)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:

Find and download the COA for your product by matching the lot number on the packaging.

5 results found

Lot NumberCertificate TypeDateItem
C2131296Certificate of AnalysisJan 16, 2025 H157106
C2131297Certificate of AnalysisJan 16, 2025 H157106
B2317877Certificate of AnalysisDec 13, 2022 H157106
B2317878Certificate of AnalysisDec 13, 2022 H157106
B2317893Certificate of AnalysisDec 13, 2022 H157106
Chemical and Physical Properties
Sensitivityair sensitive
Refractive Index1.46
Boil Point(°C)298°C(lit.)
Melt Point(°C)-11°C(lit.)
Molecular Weight230.460 g/mol
XLogP36.600
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count12
Exact Mass230.207 Da
Monoisotopic Mass230.207 Da
Topological Polar Surface Area25.300 Ų
Heavy Atom Count15
Formal Charge0
Complexity89.500
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
The total count of all stereochemical bonds0
Covalently-Bonded Unit Count1
Solution Calculators
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