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2-Chloromethyl tetrahydrofuran

HCID 18150
NotesReactions
Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
3003-84-7
Standard SMILES
ClCC1CCCO1
InChIKey
IVJLGIMHHWKRAN-UHFFFAOYSA-N
Molecular formula
C5H9ClO
Average molar mass
120.58 g/mol
Monoisotopic mass
120.03419259

Names & identifiers

Preferred name
2-Chloromethyl tetrahydrofuran
IUPAC
2-(chloromethyl)oxolane
English name
Tetrahydrofurfuryl chloride
Molecular formula
C5H9ClO
Molecular weight
120.58

Names & synonyms

Tetrahydrofurfuryl chloride2-(Chloromethyl)oxolane2-(Chloromethyl)tetrahydrofuranFuran, 2-(chloromethyl)tetrahydro-2-Chloromethyltetrahydrofuran2-CHLOROMETHYL TETRAHYDROFURANHSDB 2114NSC 2874EINECS 221-102-3UNII-R874RQ16IGBRN 0102716R874RQ16IG
Show more names
AKOS BBS-00003854TIMTEC-BB SBB008957Tetrahydrofuran chlorideTetrahydrofurfuryl chloridTETRAHYDRODURFURYL CHLORIDE(2S)-2-(chloromethyl)oxolaneTetrahydrofurfurylchloride,98%
AI3-17421NSC-2874IVJLGIMHHWKRAN-UHFFFAOYSA-DTXSID408839305-17-01-00079 (Beilstein Handbook Reference)2-CHLOROMETHYL TETRAHYDROFURAN [HSDB]2(Chloromethyl)oxolaneRefChem:86508

Database identifiers

CAS
3003-84-7
PubChem CID
18150
DTXSID
DTXSID40883930
UNII
R874RQ16IG
EC Number
221-102-3
Nikkaji
J49.587E

Properties

Computed structural properties

XLogP
1.2
Topological polar surface area
9.2 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
1
Rotatable bonds
1
Heavy atoms
7
Formal charge
0
Complexity
56

Experimental & physicochemical properties

Chemical ClassesOther Classes -> Halogenated Ethers
SpringerMaterials PropertiesOptical coefficient
Density1.110 @ 25 °C
Boiling Point150-151 °C
Refractive IndexRefractive index: 1.4550 @ 20 °C/D
Physical DescriptionLiquid; [MSDSonline]

Physicochemical properties

Boiling point
150 · 150-151 °C(lit.)
Density
1.11 g/mL · 1.11 g/mL at 25 °C(lit.)
refractive index
20 · n20/D 1.455(lit.)
Flash point
47 °C · 47 °C
storage temp.
2 · 2-8°C
solubility
Not miscible or difficult to mix.

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

H226 (100%): Flammable liquid and vapor [Warning Flammable liquids]

P210, P233, P240, P241, P242, P243, P261, P264, P264+P265, P271, P280, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P370+P378, P403+P233, P403+P235, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 47 reports by companies from 7 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard information

Regulatory InformationTetrahydrofurfuryl chloride: Does not have an individual approval but may be used under an appropriate group standard
Hazards SummaryIntraperitoneal LDLo (mouse) = 250 mg/kg; [RTECS] An irritant; [MSDSonline] See Tetrahydrofuran.
Hazard Classes and CategoriesFlam. Liq. 3 (100%)

Safety & protection

Disposal Methods · 1 item

SRP: At the time of review, criteria for land treatment or burial (sanitary landfill) disposal practices are subject to significant revision. Prior to implementing land disposal of waste residue (including waste sludge), consult with environmental regulatory agencies for guidance on acceptable disposal practices.

Toxicology

Antidote and Emergency Treatment · 2 items

Chemistry & industry

Uses & manufacturing

Formulations/Preparations98%
General Manufacturing InformationFuran, 2-(chloromethyl)tetrahydro-: ACTIVE

Applications

UsesTetrahydrofurfuryl chloride is an important raw material and intermediate used in organic synthesis, pharmaceuticals agrochemicals and dyestuff fields.

Upstream & downstream products

Upstream raw materials

1H-BenzotriazoleTetrahydrofurfuryl alcoholDichloromethaneThionyl chloride

Downstream products

Tricosene (7Z)

Suppliers100 total

梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
阿诺西(上海)生物技术有限公司400-1107768 15058188853 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]

Related reactions

16 records
New reaction record
HRID 9227 reaction equation
HRID 9227As reactantuspto-grants-2006_08
HRID 373010 reaction equation
HRID 373010As reactantuspto-grants-1992_11
HRID 878267 reaction equation
HRID 878267As reactantuspto-grants-2015_03
HRID 1070720 reaction equation
HRID 1070720As reactantuspto-grants-2005_06
HRID 1145895 reaction equation
HRID 1145895As reactantTraining data from https://doi.org/10.1039/C8SC04228D (7/10)
HRID 1181904 reaction equation
HRID 1181904As reactantuspto-grants-2007_10
HRID 1483907 reaction equation
HRID 1483907As reactantuspto-grants-2016_08
HRID 1532857 reaction equation
HRID 1532857As reactantuspto-grants-2001_03
Page 1 of 2

Compound notes

Loading…

On this pageBasic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
form
clear liquid
color
Colorless to Light yellow
Sensitive
Moisture Sensitive
BRN
102716 · 102716
InChI
InChI=1S/C5H9ClO/c6-4-5-2-1-3-7-5/h5H,1-4H2
InChIKey
IVJLGIMHHWKRAN-UHFFFAOYSA-N
SMILES
O1CCCC1CCl
CAS DataBase Reference
3003 · 3003-84-7(CAS DataBase Reference)
EWG's Food Scores
1 · 1
FDA UNII
874 RQ16IG · R874RQ16IG
NIST Chemistry Reference
Tetrahydrofurfuryl chloride(3003-84-7)
EPA Substance Registry System
2 · Furan, 2-(chloromethyl)tetrahydro- (3003-84-7)
UNSPSC Code
12352100 · 12352100
NACRES
22 · NA.22
Symbol(GHS)
2 · GHS02,GHS07
Signal word
Warning
Hazard statements
226 · H226-H315-H319-H335
Precautionary statements
303 · P303+P361+P353-P405-P501a-P210-P233-P240-P241+P242+P243-P264-P280-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313-P403+P235-P501-P261-P305+P351+P338
target organs
Respiratory system
PPE
Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter
Hazard Codes
Xi
Risk Statements
10 · 10-36/37/38
Safety Statements
26 · 26-36/37/39-24/25-16
RIDADR
1993 · UN 1993 3/PG 3
WGK Germany
3 · 3
RTECS
350000 · LU0350000
F
21 · 21-10
TSCA
TSCA listed
HazardClass
3 · 3
PackingGroup
III
HS Code
29321900 · 29321900
Storage Class
3 · 3 - Flammable liquids
Hazard Classifications
2 Flam · Eye Irrit. 2Flam. Liq. 3Skin Irrit. 2STOT SE 3
Hazardous Substances Data
3003 · 3003-84-7(Hazardous Substances Data)
Limited Quantities
5 L · 5.0 L (1.3 gallons) (liquid)
Excepted Quantities
Max Inner Pack (30g or 30ml) and Max Outer Pack (1Kg or 1L)

Basic treatment: Establish a patent airway. Suction if necessary. Watch for signs of respiratory insufficiency and assist ventilations if necessary. Administer oxygen by nonrebreather mask at 10 to 15 L/min. Provide a low-stimulus environment. Monitor for shock and treat if necessary ... . Anticipate seizures and treat if necessary ... . For eye contamination, flush eyes immediately with water. Irrigate each eye continuously with normal saline during transport ... . Do not use emetics. For ingestion, rinse mouth and administer 5 ml/kg up to 200 ml of water for dilution if the patient can swallow, has a strong gag reflex, and does not drool. Treat frostbite by rapid rewarming ... . /Ethers and related compounds/

Advanced treatment: Consider orotracheal or nasotracheal intubation for airway control in the patient who is unconscious or in respiratory arrest. Monitor cardiac rhythm and treat arrhythmias if necessary ... . Start an IV with D5W /SRP: "To keep open", minimal flow rate/. Use lactated Ringer's if signs of hypovolemia are present. Watch for signs of fluid overload. For hypotension with signs of hypovolemia, administer fluid cautiously. Consider vasopressors for hypotension with a normal fluid volume. Treat seizures with diazepam ... . Use proparacaine hydrochloride to assist eye irrigation ... . /Ethers and related compounds/

Safety data

F
21-10
PPE
Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter
wgk
3
tsca
TSCA listed
rtecs
LU0350000
ridadr
UN 1993 3/PG 3
hs_code
29321900
risk_code
10-36/37/38
Signal word
Warning
Symbol(GHS)
GHS02,GHS07
hazard_code
Xi
safety_code
26-36/37/39-24/25-16
hazard_class
3
Storage Class
3 - Flammable liquids
packing_group
III
target organs
Respiratory system
Hazard statements
H226-H315-H319-H335
Limited Quantities
5.0 L (1.3 gallons) (liquid)
Excepted Quantities
Max Inner Pack (30g or 30ml) and Max Outer Pack (1Kg or 1L)
Hazard Classifications
Eye Irrit. 2Flam. Liq. 3Skin Irrit. 2STOT SE 3
Precautionary statements
P303+P361+P353-P405-P501a-P210-P233-P240-P241+P242+P243-P264-P280-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313-P403+P235-P501-P261-P305+P351+P338
Hazardous Substances Data
3003-84-7(Hazardous Substances Data)
湖北鑫杰成化工科技有限公司
13554075426 · [email protected]
河南赢创生物科技有限公司16650615803 · [email protected]
湖南嘉航医药科技有限公司85521272 15200744171 · [email protected]
爱斯特(成都)生物制药股份有限公司+86-28-85122536 85324413 · [email protected]
上海仲因实业有限公司2537653158 16621191650 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
郑州鸿晟医药科技有限公司0371-55695890 15637198702 · [email protected]
Syntechem Co.,Ltd[email protected]
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]
北京索莱宝科技有限公司010-50973130 17801761073 · [email protected]
北京东华力拓科技发展有限公司010-88425576 · [email protected]
阿法埃莎(中国)化学有限公司400-6106006 · [email protected]
武汉卡诺斯科技有限公司027-83238443 15327105076 · [email protected]
上海瀚鸿科技股份有限公司021-54306202 13764082696 · [email protected]
上海有德化工科技有限公司021-37910092 15821801668 · [email protected]
韶远科技(上海)有限公司021-50795510 4000665055 · [email protected]
上海景颜化工科技有限公司13817811078 · [email protected]
湖北广奥生物科技有限公司027-02702759223056 18162699093 · [email protected]
湖北微斯汀科技有限公司027-61182895 13367240285 · [email protected]
山东西亚化学有限公司13355009207 13355009207 · [email protected]
广东大小化工有限公司1866-171603 18666171603 · [email protected]
玛雅试剂+86 (573) 82222445 (0)18006601000 452520369 · [email protected]
艾科试剂4008-755-333 18080918076 · [email protected]
上海思域化工科技有限公司86-21-34053660 · [email protected]
赛默飞世尔科技(中国)有限公司800-810-5118 · [email protected]
TOKYO CHEMICAL INDUSTRY CO., LTD.03-36680489 · [email protected]
武汉卡诺斯科技有限公司153-37111468 15337111468 · [email protected]
上海睿升化工科技有限公司+86-021-50935922
苏州亚科科技股份有限公司0512-87182055 13451648594 · [email protected]
河南赢创生物科技有限公司15672878902 · [email protected]
安徽科迪达化工有限公司0554-2106669 · [email protected]
郑州鸿晟医药科技有限公司0371-0371-13526885213 15637198702 · [email protected]
成都零六生物科技有限公司400-1166-196 13458535857 · [email protected]
雷丁试剂0510-85629785 18013409632 · [email protected]
湖南华腾制药有限公司400-8592883 · [email protected]
天津安浩生物科技有限公司[email protected]
康迪斯化工(湖北)有限公司13125172151 · [email protected]
池州凯隆进出口贸易有限公司[email protected]
普善实业(陕西)有限公司029-81310890 18165209495 · [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]
湖北源梦生物科技有限公司027-68897569 18120462897 · [email protected]
广东翁江化学试剂有限公司0751-2886766 13927870850 · [email protected]
湖北源梦生物科技有限公司027-68897569 18120462897 · [email protected]
石家庄康西生物科技有限公司13803336640 · [email protected]
嘉兴市浙嘉生物科技有限公司0573-85609002 · [email protected]
郑州阿尔法化工有限公司0371-53765687 18937137882 · [email protected]