Basic information
- CAS
214360-58-4- Standard SMILES
CC1(C)OB(c2ccc(F)cc2)OC1(C)C- InChIKey
SBWKQMCGTSWDPE-UHFFFAOYSA-N- Molecular formula
- C12H16BFO2
- Average molar mass
- 222.07 g/mol
- Monoisotopic mass
- 222.12273837
Names & identifiers
- Preferred name
- 2-(4-Fluorophenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
- IUPAC
- 2-(4-fluorophenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
- English name
- 4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)fluorobenzene
- Molecular formula
- C12H16BFO2
- Molecular weight
- 222.06
Names & synonyms
214360-58-42-(4-fluorophenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane4-Fluorophenylboronic acid pinacol esterDTXSID20375247RefChem:457702DTXCID40326276671-855-0941-113-34-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)fluorobenzene4-fluorophenylboronic acid, pinacol esterMFCD03453665C12H16BFO2
Show more names
4-FLUOROPHENYLBSWZn-214360-58-44-fluorophenylborate pinacol ester4-Fluorobenzeneboronic acid, pinacol ester 97%1,3,2-Dioxaborolane,2-(4-fluorophenyl)-4,4,5,5-tetraMethyl-1-Fluoro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzene
AKOS0158932684-fluorobenzeneboronic acid, pinacol ester4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)-fluorobenzene(4-FLUOROPHENYL)BORONIC ACID PINACOL ESTER1,3,2-DIOXABOROLANE, 2-(4-FLUOROPHENYL)-4,4,5,5-TETRAMETHYL-SCHEMBL10323SCHEMBL2659012SBB096239
Database identifiers
- CAS
214360-58-4- PubChem CID
- 2760593
- DTXSID
DTXSID20375247- EC Number
- 671-855-0、941-113-3
- Nikkaji
- J2.241.261B
Properties
Computed structural properties
- Topological polar surface area
- 18.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 244
Physicochemical properties
- Boiling point
- 279.4 · 279.4±23.0 °C(Predicted)
- Density
- 1.05 · 1.05±0.1 g/cm3(Predicted)
- storage temp.
- Keep in dark place,Sealed in dry,Room Temperature
- form
- powder to lump to clear liquid
- color
- White or Colorless to Light yellow to Light orange
- InChI
- 1S/C12H16BFO2/c1-11(2)12(3,4)16-13(15-11)9-5-7-10(14)8-6-9/h5-8H,1-4H3
- InChIKey
- SBWKQMCGTSWDPE-UHFFFAOYSA-N
- SMILES
- B2(OC(C(O2)(C)C)(C)C)c1ccc(cc1)F
- UNSPSC Code
- 12352200 · 12352200
- NACRES
- 21 · NA.21
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335
- Precautionary statements
- 261 · P261-P305+P351+P338
- Hazard Codes
- Xn
- Risk Statements
- 22 · 22
- WGK Germany
- 3 · 3
- HazardClass
- IRRITANT
- HS Code
- 2931900090 · 2931900090
- Storage Class
- 11 · 11 - Combustible Solids
- Hazard Classifications
- 4 Oral · Acute Tox. 4 Oral
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
Warning
H302 (95.3%): Harmful if swallowed [Warning Acute toxicity, oral]
P264, P270, P301+P317, P330, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 43 reports by companies from 5 notifications to the ECHA C&L Inventory.
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
Hazard information
Hazard Classes and Categories
Acute Tox. 4 (95.3%)
Acute Tox. 4 (100%)
Safety data
- wgk
- 3
- hs_code
- 2931900090
- risk_code
- 22
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xn
- hazard_class
- IRRITANT
- Storage Class
- 11 - Combustible Solids
- Hazard statements
- H315-H319-H335
- Hazard Classifications
- Acute Tox. 4 Oral
- Precautionary statements
- P261-P305+P351+P338
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Downstream products
Suppliers87 total
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]
上海毕合生物化学技术有限公司13816464724 · [email protected]
上海腾准生物科技有限公司19821570922 · [email protected]
杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [email protected]
VladaChem GmbH+49-7246-3082843 +86-18411632868 · [email protected]
韶远科技（上海）有限公司021-50795510 4000665055 · [email protected]
郑州德元凯化工有限公司17837139533 · [email protected]
北京华威锐科化工有限公司0757-86329057 18934348241 · [email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
武汉凯威斯科技有限公司86-027-67849912 · [email protected]
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常州科化生物科技有限公司0519-68985668 13685222090 · [email protected]
上海瀚鸿科技股份有限公司021-54306202 13764082696 · [email protected]
上海相辉医药科技有限公司13761987713 · [email protected]
烟台正信新材料科技有限公司13854547682 13854547682 · [email protected]
无锡丽恒昇生物医药科技有限公司15250805028 15250805028 · [email protected]
宁波保税区菲立化学有限公司+86 (576) 8169-6106 · [email protected]
上海健超生物科技有限公司150-2103-5486 18017383231 · [email protected]
TCI AMERICA800-4238616 · [email protected]
TOKYO CHEMICAL INDUSTRY CO., LTD.03-36680489 · [email protected]
TCI Europe320-37350700 · [email protected]
成都麦卡希化工有限公司028-85632863 18108198598 · [email protected]
上海贤鼎生物科技有限公司4009209199 · [email protected]
上海睿升化工科技有限公司+86-021-50935922
上海毕得医药科技股份有限公司400-164-7117 18317119277 · [email protected]
Labnetwork lnc.+86-27-50766799 +86-18062016861 · [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]
青岛海智微元生物科技有限公司18317699790 18317699790 · [email protected]
南京代盟化工有限公司025-66800956 18800000000 · [email protected]
铜陵恒优生物科技有限公司021-50426030 13856289449;13124863828 · [email protected]
Hangzhou Proserre Chemical Co.,Ltd.+86-571-86088112 · [email protected]
聊城莱博特生物医药科技有限公司0635-893290 · [email protected]
上海阿拉丁生化科技股份有限公司6206333 13167063860 · [email protected]
江西弗莱医药科技有限公司15870833005 · [email protected]
上海伟聂化工科技有限公司15902145085 · [email protected]
武汉凯威斯科技有限公司027-67849912 · [email protected]
硼诺科技（北京）有限公司010-15313962280 15313962280 · [email protected]
上海源叶生物科技有限公司13636370518 · [email protected]
上海瀚思化工有限公司17717618050 · [email protected]
大连金点生物科技有限公司0411-0411-00000000 13644282108 · [email protected]
杭州摩库生物医药科技有限公司400-711-5280 86-571-81025280 · [email protected]
烟台博运生物科技有限公司13793517650 13793517650 · [email protected]
西安峥鎏生物科技有限公司15594552852 · [email protected]
江苏艾康生物医药研发有限公司025-66113011 19370895928 · [email protected]
北京科富瑞德科技发展有限责任公司010-60279497 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 400821072 · [email protected]
天津希恩思生化科技有限公司400-6387771-6039 18920764717 · [email protected]
河南奥诗曼生物科技有限公司13761588971 17719817155 · [email protected]
Related reactions
6 records
Compound notes
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