1-Heptanethiol - ≥98% , CAS No.1639-09-4

CAS: 1639-09-4 Cat. No.: H102322 Formule: C7H16S Poids moléculaire: 132.27 Beilstein Registry Number: 1731687 Numéro CE: 216-678-8
DISPONIBLE À COMMANDE
GRADE & PURITY ≥98%
Synonyms
LS-13385 | Mercaptan C7 | BRN 1731687 | Heptylthiol | n-Heptylmercaptan | FT-0607876 | HEPTANE-1-THIOL [FHFI] | heptanethiol | 380ZE61GR2 | Heptyl thiol | UNII-380ZE61GR2 | 1-heptylthiol | NSC71119 | A810525 | 1-HEPTANETHIOL | FEMA NO. 4259 | USAF EK-2122
Storage
Argon charged,Room temperature
Shipped In
Normal
★
Size
Allemagne (EU)
USA*
Price
Qty
5g
H102322-5g
4 En stock
7 En stock
34,62€
10g
H102322-10g
—
1 En stock
61,52€
25g
H102322-25g
Sur commande · 8–12 semaines
134,41€
100g
H102322-100g
Sur commande · 8–12 semaines
407,75€
Enter a quantity for the sizes you want to add.
🧪
Why this grade

≥98% 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 5 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Specifications

Synonymes
LS-13385 | Mercaptan C7 | BRN 1731687 | Heptylthiol | n-Heptylmercaptan | FT-0607876 | HEPTANE-1-THIOL [FHFI] | heptanethiol | 380ZE61GR2 | Heptyl thiol | UNII-380ZE61GR2 | 1-heptylthiol | NSC71119 | A810525 | 1-HEPTANETHIOL | FEMA NO. 4259 | USAF EK-2122
Spécifications et pureté
≥98%
Conditions de stockage de stockage
Argon charged,Room temperature
Expédié en
Normal
Pureté
≥98%
Noms et identifiants
Pubchem Sid
Sourires canoniques
CCCCCCCS
IUPAC Name
heptane-1-thiol
InChIKey
VPIAKHNXCOTPAY-UHFFFAOYSA-N
INCHI
1S/C7H16S/c1-2-3-4-5-6-7-8/h8H,2-7H2,1H3
Isomères SMILES
CCCCCCCS
WGK Allemagne
3
RTECS
MJ1400000
Numéro ONU
1228
Groupe d'emballage
II
Poids moléculaire
132.27
Beilstein
1731687
Reaxy-Rn
1731687
Reaxys-RN_link_address
https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1731687&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
ClasseThiols
SubclassAlkylthiols
Intermediate Tree Nodes Not available
Direct ParentAlkylthiols
Alternative Parents Hydrocarbon derivatives  
Molecular FrameworkAliphatic acyclic compounds
Substituents Alkylthiol - Hydrocarbon derivative - Aliphatic acyclic compound
DescriptionThis 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
Structure 3D
Modèle de structure chimique interactif





Certificats (CoA, COO, BSE/TSE et tableau d'analyse)
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.

10 results found

Lot NumberCertificate TypeDateArticle
C2625125Certificate of AnalysisApr 08, 2026 H102322
A2619122Certificate of AnalysisJan 27, 2026 H102322
B2224340Certificate of AnalysisDec 10, 2025 H102322
J1825002Certificate of AnalysisAug 12, 2022 H102322
J1825003Certificate of AnalysisAug 12, 2022 H102322
A2415188Certificate of AnalysisJan 26, 2022 H102322
A2507114Certificate of AnalysisJan 26, 2022 H102322
B2224352Certificate of AnalysisJan 26, 2022 H102322
F2622014Certificate of AnalysisJan 26, 2022 H102322
I2504084Certificate of AnalysisJan 26, 2022 H102322
Propriétés chimiques et physiques
SolubilitéInsoluble in water, easily soluble in alcohol and ether.
SensibilitéAir Sensitive
Indice de réfraction1.4500-1.4530
Point d'éclair (°F)46 °C
Point d'éclair (°C)46°C
Point d'ébullition (°C)173-176°C
Point de fusion (°C)-43°C
Poids moléculaire132.270 g/mol
XLogP33.900
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count5
Exact Mass132.097 Da
Monoisotopic Mass132.097 Da
Topological Polar Surface Area1.000 Ų
Heavy Atom Count8
Formal Charge0
Complexity35.400
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
Citations of This Product
Calculateurs de solution
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