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Chloromethyl octyl ether

HCID 534743
NotesReactions
Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
24566-90-3
Standard SMILES
CCCCCCCCOCCl
InChIKey
YUMNZEWYPUBSQA-UHFFFAOYSA-N
Molecular formula
C9H19ClO
Average molar mass
178.7 g/mol
Monoisotopic mass
178.1124429

Names & identifiers

Preferred name
Chloromethyl octyl ether
IUPAC
1-(chloromethoxy)octane
English name
Chloromethyl octyl ether
Molecular formula
C9H19ClO
Molecular weight
178.7

Names & synonyms

Chloromethyl octyl ether24566-90-3DTXSID60336579RefChem:125446DTXCID10287668628-899-0YUMNZEWYPUBSQA-UHFFFAOYSA-N1-(Chloromethoxy)octaneChloromethyloctyletherOctane, 1-(chloromethoxy)-MFCD00010767chloromethyloctyl ether
Show more names
Octyl(chloromethyl) etherChloromethyl octyl ether 95%
octyl chloromethyl ether1-(Chloromethoxy)octane #SCHEMBL503543Chloromethyl octyl ether, 95%AKOS015916066AS-58943SY309406DB-046487

Database identifiers

CAS
24566-90-3
PubChem CID
534743
DTXSID
DTXSID60336579
EC Number
628-899-0
Nikkaji
J267.225A

Properties

Computed structural properties

XLogP
4.2
Topological polar surface area
9.2 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
1
Rotatable bonds
8
Heavy atoms
11
Formal charge
0
Complexity
66.6

Experimental & physicochemical properties

SpringerMaterials PropertiesNuclear quadrupole resonance spectroscopy

Physicochemical properties

Boiling point
184 · 184-185 °C(Press: 300 Torr)
Density
0.924 g/mL · 0.924 g/mL at 25 °C (lit.)
refractive index
20 · n20/D 1.437(lit.)
Flash point
192 °F · 192 °F
storage temp.
2 · 2-8°C
InChI
1S/C9H19ClO/c1-2-3-4-5-6-7-8-11-9-10/h2-9H2,1H3
InChIKey
YUMNZEWYPUBSQA-UHFFFAOYSA-N
SMILES
CCCCCCCCOCCl
UNSPSC Code
12352100 · 12352100
NACRES
22 · NA.22
Symbol(GHS)
7 · GHS07,GHS08
Signal word
Warning
Hazard statements
315 · H315-H319-H335-H351
Precautionary statements
202 · P202-P261-P264-P302+P352-P305+P351+P338-P308+P313
target organs
Respiratory system
PPE
Eyeshields, Gloves, type ABEK (EN14387) respirator filter
Hazard Codes
Xn
Risk Statements
36 · 36/37/38-40
Safety Statements
23 · 23-26-28-36/37/39-36/37
RIDADR
3334 · UN 3334
WGK Germany
3 · 3
Storage Class
10 · 10 - Combustible liquids
Hazard Classifications
2 Eye · Carc. 2Eye Irrit. 2Skin Irrit. 2STOT SE 3

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

GHS classification

GHS Classification · 4 items

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]

P203, P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P318, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 40 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard information

Hazard Classes and CategoriesSkin Irrit. 2 (100%)

Safety data

PPE
Eyeshields, Gloves, type ABEK (EN14387) respirator filter
wgk
3
ridadr
UN 3334
risk_code
36/37/38-40
Signal word
Warning
Symbol(GHS)
GHS07,GHS08
hazard_code
Xn
safety_code
23-26-28-36/37/39-36/37
Storage Class
10 - Combustible liquids
target organs
Respiratory system
Hazard statements
H315-H319-H335-H351
Hazard Classifications
Carc. 2Eye Irrit. 2Skin Irrit. 2STOT SE 3
Precautionary statements
P202-P261-P264-P302+P352-P305+P351+P338-P308+P313

Chemistry & industry

Applications · 1 item

UsesChloromethyl octyl ether has been employed as chloromethylation reagent:in chloromethylation of calix[4]arene, methyl ethers of calix[6]arene and calix[8]arenein the synthesis of chloromethylated poly(phthalazinone ether sulfone ketone)in chloromethylation of polyetherethersulphone-polyethersulphone copolymersfor polymers

Suppliers13 total

上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]
江苏艾康生物医药研发有限公司025-66061636 19370895928 · [email protected]
Aladdin Scientific[email protected]
安耐吉化学&3A(安徽泽升科技股份有限公司)400-0056266 · [email protected]
烟台盛凯伦生物制品有限公司13356901049 · [email protected]
Sigma-Aldrich西格玛奥德里奇(上海)贸易有限公司021-61415566 800-8193336 · [email protected]
上海阿拉丁生化科技股份有限公司6206333 13167063860 · [email protected]
烟台盛凯伦化学科技有限公司13356901049 · [email protected]
上海迈瑞尔生化科技有限公司18621169109 · [email protected]
重庆卡兰医药有限公司[email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
上海齐奥化工科技有限公司021-58892003 · [email protected]
Dideu Industries Group Limited+86-29-81148696 +86-15129568250 · [email protected]

Related reactions

4 records
New reaction record
HRID 1589232 reaction equation
HRID 1589232As productuspto-grants-1986_02
HRID 1589233 reaction equation
HRID 1589233As productuspto-grants-1986_02
HRID 2258057 reaction equation
HRID 2258057As reactantuspto-grants-1997_08
HRID 2260457 reaction equation
HRID 2260457As reactantuspto-grants-1995_12

Compound notes

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On this pageBasic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes