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2-Fluoro-5-iodotoluene

HCID 521178
NotesReactions
Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
452-68-6
Standard SMILES
Cc1cc(I)ccc1F
InChIKey
DYQIYXDSKUUZRI-UHFFFAOYSA-N
Molecular formula
C7H6FI
Average molar mass
236.02 g/mol
Monoisotopic mass
235.94982641

Names & identifiers

Preferred name
2-Fluoro-5-iodotoluene
IUPAC
1-fluoro-4-iodo-2-methylbenzene
English name
2-Fluoro-5-iodotoluene
Molecular formula
C7H6FI
Molecular weight
236.03

Names & synonyms

2-Fluoro-5-iodotoluene452-68-61-Fluoro-4-iodo-2-methylbenzeneEINECS 207-206-1DTXSID70196424RefChem:472479DTXCID80118915207-206-1MFCD00013710Benzene, 1-fluoro-4-iodo-2-methyl-1-fluoro-4-iodo-2-methyl-benzene4-fluoro-3-methyl-iodobenzene
Show more names
Α,Α′-DIBROMO-M-XYLENEBUTTPARK 45\01-602-Fluoro-5-iodotolue5-Iodo-2-fluorotoluene2-fluoro-5-iodootoluene2-Fluoro-5-iodotoluene>high qualtiy Trichlorphon2-Fluoro-5-iodotoluene 99%
SCHEMBL1049725SCHEMBL25182321SCHEMBL301764091-Fluoro-4-iodo-2-methylbenzene #SBB098506AKOS009159271AC-9826CS-W010322

Database identifiers

CAS
452-68-6
PubChem CID
521178
DTXSID
DTXSID70196424
EC Number
207-206-1
Nikkaji
J149.706E

Properties

Computed structural properties

XLogP
3
Topological polar surface area
0 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
1
Rotatable bonds
0
Heavy atoms
9
Formal charge
0
Complexity
94.9

Physicochemical properties

Boiling point
86 · 86-87°C 9mm
Density
1.788 · 1.788±0.06 g/cm3(Predicted)
refractive index
1.578 · 1.578
Flash point
86 · 86-87°C/9mm
storage temp.
Keep in dark place,Sealed in dry,Room Temperature
form
clear liquid
color
Colorless to Almost colorless
Sensitive
Light Sensitive
BRN
2433078 · 2433078
CAS DataBase Reference
452 · 452-68-6(CAS DataBase Reference)
NIST Chemistry Reference
2 · 2-Fluoro-5-iodotoluene(452-68-6)
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
315 · H315-H319
Precautionary statements
264 · P264-P280a-P305+P351+P338-P321-P332+P313-P337+P313

Safety & regulation

GHS classification

GHS Classification · 4 items

Warning

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

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, 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 7 reports by companies from 4 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

hs_code
29039990
risk_code
36/38-52-22
Signal word
Warning
Symbol(GHS)
GHS07
hazard_code
Xi,Xn
safety_code
26-36
hazard_class
IRRITANT
Hazard statements
H315-H319
Precautionary statements
P264-P280a-P305+P351+P338-P321-P332+P313-P337+P313

Chemistry & industry

Applications

Uses2-Fluoro-5-iodotoluene is mainly used to control various pests on vegetables, fruit trees, tea, mulberry, cotton, and grain crops. It can also be used as a sanitary pesticide and to control livestock parasites.

Upstream & downstream products

Upstream raw materials

ChloralEthanolPhosphorus trichlorideMethanol

Downstream products

DichlorvosTrichlorfon+Triazophos,E.C.

Suppliers100 total

梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
毕佳索(上海毕得医药科技股份有限公司)400-6005915 · [email protected]
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]
武汉欣扬瑞和化学科技有限公司13720274133 · [email protected]
杭州品高化工有限公司0571-87658025 · [email protected]
上海腾准生物科技有限公司19821570922 · [email protected]

Related reactions

5 records
New reaction record
HRID 311140 reaction equation
HRID 311140As reactantTraining data from https://doi.org/10.1039/C8SC04228D (8/10)
HRID 477869 reaction equation
HRID 477869As reactantuspto-grants-1989_12
HRID 927082 reaction equation
HRID 927082As reactantuspto-grants-2016_03
HRID 1147986 reaction equation
HRID 1147986As reactantTraining data from https://doi.org/10.1039/C8SC04228D (7/10)
HRID 2240939 reaction equation
HRID 2240939As reactantuspto-grants-2010_05

Compound notes

Loading…

On this pageBasic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
Hazard Codes
Xi,Xn
Risk Statements
36 · 36/38-52-22
Safety Statements
26 · 26-36
HazardClass
IRRITANT
HS Code
29039990 · 29039990
温州共赢化学有限公司+86-0086-577-64498589 +86-15355981851 · [email protected]
上海赫文斯化工有限公司15721252604 17321035817 · [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]
韶远科技(上海)有限公司021-50795510 4000665055 · [email protected]
Ark Pharm, Inc.847-367-3680 · [email protected]
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]
上海辅欣医药科技有限公司+86-021-021-50872116 · [email protected]
上海颖心实验室设备有限公司021-59178156 17002132182 · [email protected]
阿法埃莎(中国)化学有限公司400-6106006 · [email protected]
石家庄斯迪亚诺精细化工有限公司0311-89250318 13582355795 · [email protected]
武汉凯威斯科技有限公司86-027-67849912 · [email protected]
Allfluoro Pharmaceutical Company Limited+86-400-0216110 +86-15958047586 · [email protected]
上海瀚鸿科技股份有限公司021-54306202 13764082696 · [email protected]
广东方信生物科技有限公司0751-2838688 13376594225 · [email protected]
安徽合诺生物科技有限公司18455579438
南京代盟化工有限公司02566880956 · [email protected]
上海景颜化工科技有限公司13817811078 · [email protected]
上海攀鸿化工科技有限公司021-56491756 13512199871 · [email protected]
杭州东帆化学有限公司86-0571-85151182
山东西亚化学有限公司13355009207 13355009207 · [email protected]
天津希恩思生化科技有限公司400 638 7771 · [email protected]
上海特伯化学科技有限公司+86-21-60341587 · [email protected]
TCI AMERICA800-4238616 · [email protected]
TOKYO CHEMICAL INDUSTRY CO., LTD.03-36680489 · [email protected]
TCI Europe320-37350700 · [email protected]
越林试剂021-62960152 · [email protected]
上海睿升化工科技有限公司+86-021-50935922
Clearsynth Labs Limited+91-22-26355700 · [email protected]
河南赢创生物科技有限公司15672878902 · [email protected]
上海湄水化工科技有限公司021-60549325 18616193163
上海将来实业股份有限公司021-61552785 · [email protected]
安徽科迪达化工有限公司0554-2106669 · [email protected]
上海毕得医药科技股份有限公司400-164-7117 18317119277 · [email protected]
北京奥秘佳得医药科技有限公司+86-13522808617 · [email protected]
上海石洋化工有限公司021-56795766 · [email protected]
成都零六生物科技有限公司400-1166-196 13458535857 · [email protected]
天津安浩生物科技有限公司[email protected]
上海纳谦化学科技有限公司13598610367 13598610367 · [email protected]
上海洽凡生化科技有限公司+86-021-61654350 · [email protected]
江苏艾康生物医药研发有限公司025-66028182 17714375163 · [email protected]
上海孚一生物科技有限公司+86 (21) 61124340
AN PharmaTech Co Ltd86(21)68097365 · [email protected]