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3-Chloro-2-methyl-1-propene - ≥97% , CAS No.563-47-3

3-Chloro-2-methyl-1-propene - ≥97% , CAS No.563-47-3

Name: 3-Chloro-2-methyl-1-propene - ≥97% , CAS No.563-47-3
Brand: Aladdin Scientific
SKU: C106528
Availability: InStock

CAS: 563-47-3 Cat. No.: C106528 Molecular Weight: 90.55 Beilstein Registry Number: 878160 EC Number: 209-251-2

COA

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3-Chloro-2-methyl-1-propene - ≥97% CAS No(563-47-3) by Aladdin Scientific

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AVAILABLE TO ORDER

GRADE & PURITY ≥97%

Synonyms

Storage

Store at 2-8°C

Shipped In

Wet ice,FedEx DG Service

Overview Specifications Names and Identifiers Documentation Advanced Data Taxonomic Classification 3D Structure Associated Targets(Human) Associated Targets(non-human) Mechanisms of Action Certificates（CoA,COO,BSE/TSE and Analysis Chart) Chemical and Physical Properties Solution Calculators Reviews

🧪

Why this grade

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

🌡

Storage & shipping

Store at 2-8°C Ships Wet ice,FedEx DG Service 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.

Overview

3-Chloro-2-methyl-1-propene is the reactant for the synthesis of cyclobutanone.

3-Chloro-2-methyl-1-propene was used to study ring opening polymerization of oxirane derivatives using organotin phosphate condensate. It was used to study cationic polymerization of 3-Chloro-2-methyl-1-propene using using AICI3 and A3IBr, as initiators

Specifications

Synonyms

Specifications & Purity

≥97%

Storage

Store at 2-8°C

Shipped In

Wet ice, FedEx DG Service

This product requires cold chain shipping. Ground and other economy services are not available.

Purity

≥97%

Names and Identifiers

Canonical Smiles	CC(=C)CCl
IUPAC Name	3-chloro-2-methylprop-1-ene
InChIKey	OHXAOPZTJOUYKM-UHFFFAOYSA-N
INCHI	1S/C4H7Cl/c1-4(2)3-5/h1,3H2,2H3
Isomeric SMILES	CC(=C)CCl
WGK Germany	2
RTECS	UC8050000
UN Number	2554
Packing Group	II
Molecular Weight	90.55
Beilstein	878160
Reaxy-Rn	878160
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=878160&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

Kingdom Organic compounds
- Superclass Organohalogen compounds
  - Class Organochlorides

Kingdom	Organic compounds
Superclass	Organohalogen compounds
Class	Organochlorides
Subclass	Not available
Intermediate Tree Nodes	Not available
Direct Parent	Organochlorides
Alternative Parents	Hydrocarbon derivatives Alkyl chlorides
Molecular Framework	Aliphatic acyclic compounds
Substituents	Hydrocarbon derivative - Organochloride - Alkyl halide - Alkyl chloride - Aliphatic acyclic compound
Description	This compound belongs to the class of organic compounds known as organochlorides. These are compounds containing a chemical bond between a carbon atom and a chlorine atom.
External Descriptors	organochlorine compound
1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61. DOI: 10.1186/s13321-016-0174-y

3D Structure

Associated Targets(Human)

Lymphoblastoid cell (5959 Activities)

Explore this target

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

HSD17B10 Tchem Endoplasmic reticulum-associated amyloid beta-peptide-binding protein (20669 Activities)

Discover Target: HSD17B10

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Associated Targets(non-human)

Aspergillus nidulans (364 Activities)

Explore this target

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

lef Anthrax lethal factor (7585 Activities)

Discover Target: lef

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Mechanisms of Action

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.

8 results found

Lot Number	Certificate Type	Date	Item
F2104121	Certificate of Analysis	Dec 10, 2024	C106528
F2104122	Certificate of Analysis	Dec 10, 2024	C106528
F2104123	Certificate of Analysis	Dec 10, 2024	C106528
F2104127	Certificate of Analysis	Dec 10, 2024	C106528
F2525020	Certificate of Analysis	Dec 10, 2024	C106528
B2308282	Certificate of Analysis	Nov 07, 2024	C106528
J1929181	Certificate of Analysis	May 09, 2023	C106528
I2220141	Certificate of Analysis	Jul 29, 2022	C106528

Chemical and Physical Properties

Solubility	Not miscible in water.
Sensitivity	Heat sensitive
Refractive Index	1.4262-1.4282
Flash Point(°F)	14 °F
Flash Point(°C)	-18℃
Boil Point(°C)	71-72°C
Melt Point(°C)	-80°C
Molecular Weight	90.550 g/mol
XLogP3	2.100
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	0
Rotatable Bond Count	1
Exact Mass	90.0236 Da
Monoisotopic Mass	90.0236 Da
Topological Polar Surface Area	0.000 Å²
Heavy Atom Count	5
Formal Charge	0
Complexity	38.900
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
The total count of all stereochemical bonds	0
Covalently-Bonded Unit Count	1

Solution Calculators

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Reviews

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