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Ethyl 2-bromo-2-cyclopropylacetate

HCID 44222804
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Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
1200828-74-5
Standard SMILES
CCOC(=O)C(Br)C1CC1
InChIKey
BTAPHOMYBWYDEU-UHFFFAOYSA-N
Molecular formula
C7H11BrO2
Average molar mass
207.06 g/mol
Monoisotopic mass
205.99424169

Names & identifiers

Preferred name
Ethyl 2-bromo-2-cyclopropylacetate
IUPAC
ethyl 2-bromo-2-cyclopropylacetate
English name
ETHYL 2-BROMO-2-CYCLOPROPYLACETATE
Molecular formula
C7H11BrO2
Molecular weight
207.07

Names & synonyms

ethyl 2-bromo-2-cyclopropylacetateRefChem:594239875-057-51200828-74-5MFCD18837719Bromo-cyclopropyl-acetic acid ethyl esterEthyl bromo(cyclopropyl)acetateCyclopropaneacetic acid, alpha-bromo-, ethyl esterEthyl2-bromo-2-cyclopropylacetateSCHEMBL381187ethyl a-bromocyclopropaneacetateDTXSID20657919
Show more names
Cyclopropaneacetic acid, α-bromo-, ethyl ester
BTAPHOMYBWYDEU-UHFFFAOYSA-NBthyl 2-bromo-2-cyclopropylacetateethyl alpha-bromocyclopropaneacetateAYB82874AKOS015998621Ethyl (R)-2-bromo-2-cyclopropylacetEthyl 2-bromo-2-(cyclopropyl)acetateSB31669

Database identifiers

CAS
1200828-74-5
PubChem CID
44222804
DTXSID
DTXSID20657919
EC Number
875-057-5

Properties

Computed structural properties

XLogP
2.1
Topological polar surface area
26.3 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
4
Heavy atoms
10
Formal charge
0
Complexity
132

Physicochemical properties

Boiling point
209.2 · 209.2±13.0℃ (760 Torr)
Density
1.494 · 1.494±0.06 g/cm3 (20 ºC 760 Torr)
Flash point
102.5 · 102.5±10.2℃
storage temp.
-20 °C · Inert atmosphere,Store in freezer, under -20°C
form
liquid
color
Clear, pale yellow
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
319 · H319-H335-H302+H312+H332-H315
Precautionary statements
280 · P280-P301+P312-P362+P364
HS Code
2916200090 · 2916200090

Safety & regulation

GHS classification

GHS Classification · 4 items

Warning

H302+H332 (100%): Harmful if swallowed or if inhaled [Warning Acute toxicity, oral; acute toxicity, inhalation]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Safety data

hs_code
2916200090
Signal word
Warning
Symbol(GHS)
GHS07
Hazard statements
H319-H335-H302+H312+H332-H315
Precautionary statements
P280-P301+P312-P362+P364

Chemistry & industry

Suppliers62 total

韶远科技(上海)有限公司021-50795510 4000665055 · [email protected]
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]
苏州启航生物科技有限公司18151111370 · [email protected]
毕佳索(上海毕得医药科技股份有限公司)400-6005915 · [email protected]
北京索莱宝科技有限公司010-50973130 17801761073 · [email protected]
安耐吉化学&3A(安徽泽升科技有限公司)021-58432009 400-005-6266 · [email protected]
Advanced chemblocks inc650-6922368 650-6922368;650-6922368 · [email protected]
上海相辉医药科技有限公司13761987713 · [email protected]
学研惠(武汉)科技有限公司15727060112 · [email protected]
杰达维(上海)医药科技发展有限公司/J & W PharmLab021-64340559 · [email protected]
上海宣月科技有限公司15216675652 · [email protected]
上海珂华生物科技有限公司021-60455363 18019463053 · [email protected]
深圳康特腾科技有限公司86-0755-86635001 · [email protected]
金瓯生物医药(南京)有限公司13000000000 · [email protected]
上海毕得医药科技股份有限公司400-164-7117 18317119277 · [email protected]
南京法斯特生物医药有限公司025-58390181 58390186 18912901218 · [email protected]
上海寰川实业有限公司021-61478794 · [email protected]
Chongqing jooe co., ltd+86-15223382610 · [email protected]
斯派螺(武汉)药物研发有限公司[email protected]
南京菲泓科技有限公司025-58855213 · [email protected]
HANGZHOU LEAP CHEM CO., LTD.+86-571-87711850 +86-15355479329 · [email protected]
北京汇科盈生物科技有限公司15210661751 · [email protected]
上海阿拉丁生化科技股份有限公司6206333 13167063860 · [email protected]
北京伊万景瑞生物科技有限公司15866847540 · [email protected]
南京世洲生物科技有限公司025-85563444 18351873721 · [email protected]
Guangzhou Yuheng Pharmaceutical Technology Co., Ltd+8613580539051 · [email protected]
上海源叶生物科技有限公司13636370518 · [email protected]
上海韵浦实业有限公司21-61726900 15202122459
成都同创源医药科技有限公司028-83379370 13880556291 · [email protected]
上海会兴生物科技有限公司(安 徽稠环生物科技有限公司)18621295758; 18621295758 · [email protected]
上海特伯化学科技有限公司021-58170097 · [email protected]
上海万千化工有限公司18796480002 18796480002 · [email protected]
江苏艾康生物医药研发有限公司025-66061636 19370895928 · [email protected]
上海旺珐化工科技有限公司(安徽珐诺伊医药科技有限公司)13918479294 · [email protected]
上海易恩化学技术有限公司400-400-1332688 18019345275 · [email protected]
南京合巨药业有限公司025-57027686 17372956142 · [email protected]
济南尚博医药股份有限公司0531-61320525 15866703830 · [email protected]
上海索本生物科技有限公司15088289376;13917786310 · [email protected]
Zjartspharm Co., Ltd15068876005 · [email protected]
上海珂华生物科技有限公司021-58581007 18019463053 · [email protected]
上海红乐生物科技有限公司021-56145923; 4001631568 · [email protected]
上海智乾生物科技有限公司[email protected]
济南尚博生物科技有限公司+8615866703830 · [email protected]
Accela ChemBio Inc.+1-858-6993322 +86-18019713315 · [email protected]
Aladdin Scientific[email protected]
爆牛贸易重庆有限公司+86-023-6139-8061 +86-86-13650506873 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
Hefei Hirisun Pharmatech Co., Ltd+8615056975894 · [email protected]
Shanxi Xuanran Import and Export Trade Co., Ltd.+8617735180244 · [email protected]

Related reactions

6 records
New reaction record
HRID 868832 reaction equation
HRID 868832As reactantuspto-grants-2015_03
HRID 932197 reaction equation
HRID 932197As productuspto-grants-2016_03
HRID 932199 reaction equation
HRID 932199As reactantuspto-grants-2016_03
HRID 1048511 reaction equation
HRID 1048511As productuspto-grants-2013_10
HRID 1048513 reaction equation
HRID 1048513As reactantuspto-grants-2013_10
HRID 2150894 reaction equation
HRID 2150894As reactantTraining data from https://doi.org/10.1039/C8SC04228D (4/10)

Compound notes

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On this pageBasic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes