1,3-Diphenylpropane - ≥97% , CAS No.1081-75-0

CAS: 1081-75-0 Cat. No.: D155045 Molecular Weight: 196.29 Beilstein Registry Number: 5(4)1913 EC Number: 214-101-4
AVAILABLE TO ORDER
GRADE & PURITY ≥97%
Synonyms
BS-22670 | 2-methyl benzyl chloride | Propane,3-diphenyl- | 1,1'-(1,3-Propanediyl)bisbenzene, 9CI | Benzene, 1,1'-(1,3-propanediyl)bis- (9CI) | Q27115781 | D1412 | BAA08175 | H11752 | Benzene, 1,1'- (1,3-propanediyl)bis- | EINECS 214-101-4 | DTXSID8086252
Storage
Room temperature
Shipped In
Normal
 ·  off list, applied to all prices below.
Size
Status
Price
Qty
1ml
D155045-1ml
3
$39.90
5ml
D155045-5ml
1
$139.90
Enter a quantity for the sizes you want to add.
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Why this grade

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

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Storage & shipping

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

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Quality documents

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

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Literature proof

Cited in 1 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Specifications

Synonyms
BS-22670 | 2-methyl benzyl chloride | Propane, 3-diphenyl- | 1, 1'-(1, 3-Propanediyl)bisbenzene, 9CI | Benzene, 1, 1'-(1, 3-propanediyl)bis- (9CI) | Q27115781 | D1412 | BAA08175 | H11752 | Benzene, 1, 1'- (1, 3-propanediyl)bis- | EINECS 214-101-4 | DTXSID8086252
Specifications & Purity
≥97%
Storage
Room temperature
Shipped In
Normal
Purity
≥97%
Names and Identifiers
Pubchem Sid488181947
Pubchem Sid Urlhttps://pubchem.ncbi.nlm.nih.gov/substance/488181947
Canonical SmilesC1=CC=C(C=C1)CCCC2=CC=CC=C2
IUPAC Name3-phenylpropylbenzene
InChIKeyVEAFKIYNHVBNIP-UHFFFAOYSA-N
INCHI1S/C15H16/c1-3-8-14(9-4-1)12-7-13-15-10-5-2-6-11-15/h1-6,8-11H,7,12-13H2
Isomeric SMILES C1=CC=C(C=C1)CCCC2=CC=CC=C2
Molecular Weight 196.29
Beilstein 5(4)1913
Reaxy-Rn 2044541
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2044541&ln=

Documentation

📋 Safety Data Sheet (SDS)

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

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✅ Certificate of Analysis (COA)

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

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📊 Datasheet

Quick-reference summary of product specifications and applications.

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🔬 Specification Sheet

Full quality attributes and acceptance criteria for this grade.

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Advanced Data

Taxonomic Classification

Taxonomy Tree

KingdomOrganic compounds
SuperclassPhenylpropanoids and polyketides
ClassLinear 1,3-diarylpropanoids
SubclassNot available
Intermediate Tree Nodes Not available
Direct ParentLinear 1,3-diarylpropanoids
Alternative Parents Benzene and substituted derivatives  Aromatic hydrocarbons  Unsaturated hydrocarbons  
Molecular FrameworkAromatic homomonocyclic compounds
Substituents Linear 1,3-diarylpropanoid - Benzenoid - Monocyclic benzene moiety - Aromatic hydrocarbon - Unsaturated hydrocarbon - Hydrocarbon - Aromatic homomonocyclic compound
DescriptionThis compound belongs to the class of organic compounds known as linear 1,3-diarylpropanoids. These are organic compounds with a structure based on a C6-C3-C6 skeleton, where the two benzene rings are not linked together.
External Descriptors aromatic compound
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.

9 results found

Lot NumberCertificate TypeDateItem
G2429423Certificate of AnalysisJul 17, 2024 D155045
G2429424Certificate of AnalysisJul 17, 2024 D155045
B2419111Certificate of AnalysisMar 17, 2023 D155045
D2320531Certificate of AnalysisMar 17, 2023 D155045
D2320532Certificate of AnalysisMar 17, 2023 D155045
D2320572Certificate of AnalysisMar 17, 2023 D155045
D2320759Certificate of AnalysisMar 17, 2023 D155045
D2320789Certificate of AnalysisMar 17, 2023 D155045
G2318073Certificate of AnalysisMar 17, 2023 D155045
Chemical and Physical Properties
Sensitivitymoisture sensitive
Refractive Index1.56
Boil Point(°C)83°C/0.7mmHg(lit.)
Molecular Weight196.290 g/mol
XLogP33.400
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count0
Rotatable Bond Count4
Exact Mass196.125 Da
Monoisotopic Mass196.125 Da
Topological Polar Surface Area0.000 Ų
Heavy Atom Count15
Formal Charge0
Complexity131.000
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
References
1. Zhong-Qiu Liu, Xian-Yong Wei, Xiao Zhou, Yu-Chuan Xiao, Zhan-Ku Li, Xian-Hou Guo, Sheng-Kang Wang, Yang-Yang Zhang, Zhi-Min Zong, Feng-Yun Ma, Jing-Mei Liu.  (2017)  An acidic ionic liquid modified microfiber attapulgite-supported nickel for catalytic hydroconversion of α,ω-diarylalkanes.  FUEL PROCESSING TECHNOLOGY,      [PMID:] [10.1016/j.fuproc.2017.03.011]
Solution Calculators
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