Propyl dodecanoate - ≥97% , CAS No.3681-78-5

CAS: 3681-78-5 Cat. No.: P193021 Molecular Weight: 242.4
AVAILABLE TO ORDER
GRADE & PURITY ≥97%
Synonyms
AI3-31997 | PROPYLLAURATE | D-threo-(-)-2-Amino-1-(p-nitrophenyl)-1,3-propanediol | Propyl dodecanoate, ~99% | Ethanone, 1-(1-hydroxy-2-naphthalenyl)- | FT-0688410 | Dodecanoic acid, propyl ester | AS-20063 | DTXSID30190286 | SCHEMBL332712 | LMFA07010465
Storage
Room temperature
Shipped In
Normal
 ·  off list, applied to all prices below.
Size
Status
Price
Qty
250mg
P193021-250mg
3
$9.90
1g
P193021-1g
2
$10.90
5g
P193021-5g
2
$14.90
25g
P193021-25g
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.
$49.90
100g
P193021-100g
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.
$161.90
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.

🌡

Storage & shipping

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 2 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Specifications

Synonyms
AI3-31997 | PROPYLLAURATE | D-threo-(-)-2-Amino-1-(p-nitrophenyl)-1, 3-propanediol | Propyl dodecanoate, ~99% | Ethanone, 1-(1-hydroxy-2-naphthalenyl)- | FT-0688410 | Dodecanoic acid, propyl ester | AS-20063 | DTXSID30190286 | SCHEMBL332712 | LMFA07010465
Specifications & Purity
≥97%
Storage
Room temperature
Shipped In
Normal
Purity
≥97%
Names and Identifiers
Pubchem Sid504755158
Pubchem Sid Urlhttps://pubchem.ncbi.nlm.nih.gov/substance/504755158
Canonical SmilesCCCCCCCCCCCC(=O)OCCC
IUPAC Namepropyl dodecanoate
InChIKeyFTBUKOLPOATXGV-UHFFFAOYSA-N
INCHI1S/C15H30O2/c1-3-5-6-7-8-9-10-11-12-13-15(16)17-14-4-2/h3-14H2,1-2H3
Isomeric SMILES CCCCCCCCCCCC(=O)OCCC
Molecular Weight 242.4

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
SuperclassLipids and lipid-like molecules
ClassFatty Acyls
SubclassFatty acid esters
Intermediate Tree Nodes Not available
Direct ParentFatty acid esters
Alternative Parents Carboxylic acid esters  Monocarboxylic acids and derivatives  Organic oxides  Hydrocarbon derivatives  Carbonyl compounds  
Molecular FrameworkAliphatic acyclic compounds
Substituents Fatty acid ester - Carboxylic acid ester - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Aliphatic acyclic compound
DescriptionThis compound belongs to the class of organic compounds known as fatty acid esters. These are carboxylic ester derivatives of a fatty acid.
External Descriptors Wax monoesters
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
D2602019Certificate of AnalysisApr 06, 2026 P193021
G2120225Certificate of AnalysisMay 07, 2024 P193021
G2120226Certificate of AnalysisMay 07, 2024 P193021
G2120284Certificate of AnalysisMay 07, 2024 P193021
G2120285Certificate of AnalysisMay 07, 2024 P193021
Chemical and Physical Properties
Flash Point(°C)130 °C
Boil Point(°C)242 °C
Molecular Weight242.400 g/mol
XLogP36.200
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count13
Exact Mass242.225 Da
Monoisotopic Mass242.225 Da
Topological Polar Surface Area26.300 Ų
Heavy Atom Count17
Formal Charge0
Complexity166.000
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. Lingcheng Meng, Jinling Zhang, Shuang Zhao, Desheng Qi, Pan Xu, Shuoqi Wu, Le Wang, Xigui Yue, Zhenhua Jiang.  (2022)  A Novel PEEK Foam with Ultra-High Temperature-Resistant by Temperature Induced Phase Separation.  MACROMOLECULAR MATERIALS AND ENGINEERING,  308  (5): (2200559).  [PMID:] [10.1002/mame.202200559]
2. Cheng Du, Chenglong Qiu, Zhongying Fang, Ping Li, Yijing Gao, Jianguo Wang, Wei Chen.  (2021)  Interface hydrophobic tunnel engineering: A general strategy to boost electrochemical conversion of N2 to NH3.  Nano Energy,      [PMID:] [10.1016/j.nanoen.2021.106784]
Solution Calculators
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