Basic information
- CAS
699-08-1- Standard SMILES
CCOc1ccc(I)cc1- InChIKey
VSIIHWOJPSSIDI-UHFFFAOYSA-N- Molecular formula
- C8H9IO
- Average molar mass
- 248.06 g/mol
- Monoisotopic mass
- 247.96981291
Names & identifiers
- Preferred name
- 1-Ethoxy-4-iodobenzene
- IUPAC
- 1-ethoxy-4-iodobenzene
- English name
- 4-Iodophenetole
- Molecular formula
- C8H9IO
- Molecular weight
- 248.06
Names & synonyms
1-Ethoxy-4-iodobenzene699-08-1RefChem:432239615-030-54-Iodophenetolep-Iodophenetole4-EthoxyiodobenzeneBenzene, 1-ethoxy-4-iodo-1-Ethoxy-4-iodo-benzenePhenetole, p-iodo-MFCD000611241-iodo-4-ethoxybenzene
Show more names
4-Iodophenetole98%4-Iodophenetole>4-iodobenzyl ether4-Iodophenetole 98%4-Iodophenetole,97%4-ethyloxyiodobenzene
p-Jodphenetolp-EthoxyiodobenzeneSCHEMBL7602524-Iodophenyl ethyl etherDTXSID40277739SY018622I05254-ethoxy-1-iodobenzene
Database identifiers
- CAS
699-08-1- PubChem CID
- 220700
- DTXSID
DTXSID40277739- EC Number
- 615-030-5
- Nikkaji
- J96.185J
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 9.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 87.3
Physicochemical properties
- Melting point
- 25 · 25-28 °C (lit.)
- Boiling point
- 133 · 133-134°C 19mm
- Density
- 1.6502 · 1.6502 (estimate)
- refractive index
- 1.597 · 1.5970
- Flash point
- 230 °F · >230 °F
- storage temp.
- Keep in dark place,Sealed in dry,Room Temperature
- solubility
- soluble in Methanol
- form
- powder to lump to clear liquid
- color
- White or Colorless to Yellow to Orange
- Sensitive
- Light Sensitive
- BRN
- 2042067 · 2042067
- InChI
- 1S/C8H9IO/c1-2-10-8-5-3-7(9)4-6-8/h3-6H,2H2,1H3
- InChIKey
- WSWPHHNIHLTAHB-UHFFFAOYSA-N
- SMILES
- CCOc1ccc(I)cc1
- CAS DataBase Reference
- 699 · 699-08-1(CAS DataBase Reference)
- UNSPSC Code
- 12352100 · 12352100
- NACRES
- 22 · NA.22
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335
- Precautionary statements
- 261 · P261-P264-P271-P280-P302+P352-P305+P351+P338
- target organs
- Respiratory system
- PPE
- 95 · dust mask type N95 (US), Eyeshields, Gloves
- Hazard Codes
- Xi
- Risk Statements
- 36 · 36/37/38
- Safety Statements
- 26 · 26-36
- WGK Germany
- 3 · 3
- Hazard Note
- Irritant
- HS Code
- 29093090 · 29093090
- Storage Class
- 11 · 11 - Combustible Solids
- Hazard Classifications
- 2 Skin · Eye Irrit. 2Skin Irrit. 2STOT SE 3
Safety & regulation
GHS classification
GHS Classification
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 40 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Peroxide Forming Chemical
p-Iodophenetole
D: Other compounds that may form peroxides
Kelly
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Safety data
- PPE
- dust mask type N95 (US), Eyeshields, Gloves
- wgk
- 3
- hs_code
- 29093090
- risk_code
- 36/37/38
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- hazard_note
- Irritant
- safety_code
- 26-36
- Storage Class
- 11 - Combustible Solids
- target organs
- Respiratory system
- Hazard statements
- H315-H319-H335
- Hazard Classifications
- Eye Irrit. 2Skin Irrit. 2STOT SE 3
- Precautionary statements
- P261-P264-P271-P280-P302+P352-P305+P351+P338
Chemistry & industry
Applications
Uses4-Iodophenetole may be used as one of the components in the synthesis of bis(4-ethoxyphenyl)amine.
UsesIntermediates of Liquid Crystals
Usessuzuki reaction
Upstream & downstream products
Upstream raw materials
Downstream products
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]
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INTATRADE GmbH+49 3493/605464 · [email protected]
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Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
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安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
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Shanghai Safer Pharmaceutical Technology Co., Ltd.021-31761238 · [email protected]
广东谦进化学试剂有限公司0751-2818792 13435114148 · [email protected]
孝感深远化工有限公司15527621225; 15527621225 · [email protected]
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天津希恩思生化科技有限公司400 638 7771 · [email protected]
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TCI AMERICA800-4238616 · [email protected]
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北京环宇世纪化学科技有限公司hysj_bj.com
上海将来实业股份有限公司400-0066400 13621662912 · [email protected]
上海将来实业股份有限公司021-61552785 · [email protected]
HBCChem, Inc.+1-510-219-6317 · [email protected]
上海毕得医药科技股份有限公司400-164-7117 18317119277 · [email protected]
日照力德士化工有限公司010-51268198 · [email protected]
美岚实业（上海）有限公司021-58958189 · [email protected]
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广拓化学（上海）有限公司021-60899189-8001 18918189673 · [email protected]
上海御略医药科技有限公司021-60345187 13671753212 · [email protected]
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上海嵩爰化工科技有限公司010-1234567 18521000990 · [email protected]
江苏艾康生物医药研发有限公司025-66028182 17714375163 · [email protected]
陕西缔都医药化工有限公司+86-29-87569262 +86-15003564040 · [email protected]
苏州氟洛科医药技术有限公司0512-62706796 · [email protected]
Related reactions
12 records
Compound notes
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