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5-(2-Bromoethyl)-2,3-dihydro-1-benzofuran

HCID 21831160
NotesReactions

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

Basic information

CAS
127264-14-6
Standard SMILES
BrCCc1ccc2c(c1)CCO2
InChIKey
JRKZQRRYNCMSCB-UHFFFAOYSA-N
Molecular formula
C10H11BrO
Average molar mass
227.101 g/mol
Monoisotopic mass
225.99932707

Names & identifiers

Preferred name
5-(2-Bromoethyl)-2,3-dihydro-1-benzofuran
IUPAC
5-(2-Bromoethyl)-2,3-dihydro-1-benzofuran
English name
5-(2-Bromoethyl)-2,3-dihydrobenzofuran
Molecular formula
C10H11BrO
Molecular weight
227.1

Names & synonyms

5-(2-Bromoethyl)-2Darifenacin IMpurity BDaphnexin intermediate5-(2-Bromoethyl)coumaranDarifenacin Intermediate 2Darifenacin Related Compound GDarifenacin 5-Bromoethyl Impurity5-(2 Bromoethyl)-2,3-dihyrobenzofuran5-(2-bromoethyl)-2,3-dhydrobenzofuran5-(2-BROMOETHYL)-2,3-DIHYDROBENZOFURAN

Database identifiers

CAS
127264-14-6
PubChem CID
21831160
DTXSID
DTXSID10618599
EC Number
603-191-4

Properties

Physicochemical properties

Melting point
65 · 65-67°C
Boiling point
287.7 · 287.7±9.0 °C(Predicted)
Density
1.459 · 1.459±0.06 g/cm3(Predicted)
storage temp.
Keep in dark place,Inert atmosphere,Room temperature
solubility
Chloroform, Methanol
form
Powder
color
Off-White
Major Application
pharmaceutical
InChI
1S/C10H11BrO/c11-5-3-8-1-2-10-9(7-8)4-6-12-10/h1-2,7H,3-6H2
InChIKey
JRKZQRRYNCMSCB-UHFFFAOYSA-N
SMILES
BrCCc1cc2c(cc1)OCC2
CAS DataBase Reference
127264 · 127264-14-6(CAS DataBase Reference)
UNSPSC Code
41116107 · 41116107
NACRES
24 · NA.24
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
302 · H302-H315-H319-H335
Precautionary statements
261 · P261-P305+P351+P338
Hazard Codes
Xi,Xn
Risk Statements
22 · 22
WGK Germany
3 · WGK 3
HS Code
2932990090 · 2932990090
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.

Safety data

wgk
WGK 3
hs_code
2932990090
risk_code
22
Signal word
Warning
Symbol(GHS)
GHS07
hazard_code
Xi,Xn
Storage Class
11 - Combustible Solids
Hazard statements
H302-H315-H319-H335
Hazard Classifications
Acute Tox. 4 Oral
Precautionary statements
P261-P305+P351+P338

Chemistry & industry

Applications

Usespharmaceutical

Upstream & downstream products

Upstream raw materials

2,3-Dihydro-5-benzofuranethanol2-Bromo-1-(2,3-dihydro-1-benzofuran-5-yl)ethanone5-(2-chloroethyl)-2,3-dihydrobenzofuran

Downstream products

DarifenacinDARIFENACIN

Suppliers100 total

梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
苏州道澜生物医药科技有限公司15952404857 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
北京联本医药化学技术有限公司010-83386758 18810831598 · [email protected]
Shanghai Yingrui Biopharma Co.,Ltd21-33585366 · [email protected]
普善实业(陕西)有限公司029-81310890 18165209495 · [email protected]
Baoji Guokang Healthchem co.,ltd+8615604608665 15604608665 · [email protected]

Related reactions

25 records
New reaction record
HRID 21404 reaction equation
HRID 21404As productuspto-grants-1995_06
HRID 209219 reaction equation
HRID 209219As reactantTraining data from https://doi.org/10.1039/C8SC04228D (6/10)
HRID 484332 reaction equation
HRID 484332As productuspto-grants-1993_07
HRID 974973 reaction equation
HRID 974973As productuspto-grants-1997_03
HRID 1198459 reaction equation
HRID 1198459As productuspto-grants-1994_01
HRID 1463864 reaction equation
HRID 1463864As reactantuspto-grants-1994_04
HRID 1463884 reaction equation
HRID 1463884As productuspto-grants-1994_04
HRID 1463891 reaction equation
HRID 1463891As reactantuspto-grants-1994_04
Page 1 of 4

Compound notes

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On this pageBasic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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]
毕佳索(上海毕得医药科技股份有限公司)400-6005915 · [email protected]
湖南瑞威尔生物科技有限公司15608648206 13297919155 · [email protected]
江西瑞威尔生物科技有限公司18502728206 · [email protected]
北京华威锐科化工有限公司0757-86329057 18934348241 · [email protected]
宁波亿诺化学品有限公司86-574-27787657 · [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]
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]
上海钰康生物科技有限公司+86-18930848214 +86-021-56762820 · [email protected]
上海景颜化工科技有限公司13817811078 · [email protected]
嘉兴市艾森化工有限公司0573-85285100 18627885956 · [email protected]
上海泰坦科技股份有限公司400-6009262 15618770481 · [email protected]
杭州东帆化学有限公司86-0571-85151182
苏州启航生物科技有限公司18662190603;18151111370 · [email protected]
北京科富瑞德科技发展有限责任公司+86-010-60279497 +86-15646567669 · [email protected]
四川库利南科技有限公司400-1166-196 18981987031 · [email protected]
上海迪外化工科技有限公司021-61551100
北京泰亚杰科技有限公司021-33690831-8001 13552411790;18616022633 · [email protected]
上海遐瑞医药科技有限公司+86 21 61551611
TCI AMERICA800-4238616 · [email protected]
TOKYO CHEMICAL INDUSTRY CO., LTD.03-36680489 · [email protected]
TCI Europe320-37350700 · [email protected]
深圳振强药物研发有限公司0755-66853366 13670046396 · [email protected]
越林试剂021-62960152 · [email protected]
青岛君之道生物技术有限公司0532-87118899 · [email protected]
苏州亚科科技股份有限公司0512-87182055 13451648594 · [email protected]
湖北鑫源顺医药化工有限公司13971561712, 13995564702, 027-50664929 · [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]
郑州鸿晟医药科技有限公司0371-0371-13526885213 15637198702 · [email protected]
上海石洋化工有限公司021-56795766 · [email protected]
上海御略医药科技有限公司021-60345187 13671753212 · [email protected]
上海鑫圭生物科技有限公司15121041756 · [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
凯试(上海)科技有限公司021-50135380 · [email protected]
江苏倍达医药科技有限公司0512-63009836 18994340901 · [email protected]
TargetMol中国(陶术生物)021-021-33632979 15002134094 · [email protected]
九鼎化学(上海)科技有限公司4009209199 · [email protected]
BOC Sciences16314854226; +8616314854226 · [email protected]