1-Bromohexane-d₁₃ - ≥98 atom% D,≥98% , CAS No.130131-94-1

CAS: 130131-94-1 Cat. No.: B471923 Summenformel: CD3C(CD2)4CD2Br Molekulargewicht: 178.15 EG-Nummer: 687-860-6
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GRADE & PURITY ≥98 atom% D,≥98%
Synonyms
1-bromo-1,1,2,2,3,3,4,4,5,5,6,6,6-tridecadeuteriohexane | 1-Bromohexane-d13, 98 atom % D | DTXSID50583838 | 1-Bromohexane-d13 | D99561 | 1-bromo(?H??)hexane | AKOS015910699 | 1-Bromo(~2~H_13_)hexane | J-005752
Storage
Store at 2-8°C
Shipped In
Wet ice
★
Size
Deutschland (EU)
USA*
Price
Qty
50mg
B471923-50mg
Auf Bestellung · 8–12 Wochen

213,38€

248,95€
Speichern 35,58 € (14.29%)
250mg
B471923-250mg
—
1 Auf Lager

744,43€

869,39€
Speichern 124,95 € (14.37%)
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Why this grade

≥98 atom% D,≥98% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

🌡

Storage & shipping

Store at 2-8°C Ships Wet ice 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

Synonyme
1-bromo-1,1,2,2,3,3,4,4,5,5,6,6,6-tridecadeuteriohexane | 1-Bromohexane-d13, 98 atom % D | DTXSID50583838 | 1-Bromohexane-d13 | D99561 | 1-bromo(?H??)hexane | AKOS015910699 | 1-Bromo(~2~H_13_)hexane | J-005752
Spezifikationen & Reinheit
≥98 atom% D,≥98%
Storage
Store at 2-8°C
Verschickt in
Wet ice
Dieses Produkt erfordert Kühlkettenversand. Grundversand und andere Economy-Optionen sind nicht verfügbar.
Reinheit
≥98 atom% D,≥98%
Namen und Kennungen
Pubchem Sid504768221
Pubchem Sid Urlhttps://pubchem.ncbi.nlm.nih.gov/substance/504768221
Kanonisches LächelnCCCCCCBr
IUPAC Name1-bromo-1,1,2,2,3,3,4,4,5,5,6,6,6-tridecadeuteriohexane
InChIKeyMNDIARAMWBIKFW-UTBWLCBWSA-N
INCHI1S/C6H13Br/c1-2-3-4-5-6-7/h2-6H2,1H3/i1D3,2D2,3D2,4D2,5D2,6D2
Isomere SMILES [2H]C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])Br
UN-Nummer 1993C
Molekulargewicht 178.15
Reaxy-Rn 1731290
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1731290&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
SuperclassOrganohalogen compounds
KlasseOrganobromides
SubclassNot available
Intermediate Tree Nodes Not available
Direct ParentOrganobromides
Alternative Parents Hydrocarbon derivatives  Alkyl bromides  
Molecular FrameworkAliphatic acyclic compounds
Substituents Hydrocarbon derivative - Organobromide - Alkyl halide - Alkyl bromide - Aliphatic acyclic compound
BeschreibungThis compound belongs to the class of organic compounds known as organobromides. These are compounds containing a chemical bond between a carbon atom and a bromine atom.
External Descriptors Not available
3D-Struktur
Interaktives chemisches Strukturmodell





Zertifikate (CoA, COO, BSE/TSE und Analyse-Diagramm)
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.

4 results found

Lot NumberCertificate TypeDatumArtikel
I2611050Certificate of AnalysisSep 17, 2026 B471923
H2303493Certificate of AnalysisMay 11, 2026 B471923
H2303523Certificate of AnalysisMay 11, 2026 B471923
H2302523Certificate of AnalysisJul 13, 2023 B471923
Chemische und physikalische Eigenschaften
Brechungsindexn20/D 1.4475 (lit.)
Flammpunkt (°F)134.6 °F - closed cup
Flammpunkt (°C)57 °C - closed cup
Siedepunkt (°C)154-158℃ (lit.)
Schmelzpunkt (°C)−85℃ (lit.)
Molekulargewicht178.150 g/mol
XLogP33.800
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count0
Rotatable Bond Count4
Exact Mass177.102 Da
Monoisotopic Mass177.102 Da
Topological Polar Surface Area0.000 Ų
Heavy Atom Count7
Formal Charge0
Complexity27.400
Isotope Atom Count13
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
Lösungsrechner
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