Basic information
- CAS
40630-84-0- Standard SMILES
C=CCOC(=O)CBr- InChIKey
MUWVIMJPXKIXJK-UHFFFAOYSA-N- Molecular formula
- C5H7BrO2
- Average molar mass
- 179.01 g/mol
- Monoisotopic mass
- 177.96294156
Names & identifiers
- Preferred name
- Prop-2-enyl 2-bromoacetate
- IUPAC
- prop-2-enyl 2-bromoacetate
- English name
- ALLYL BROMOACETATE
- Molecular formula
- C5H7BrO2
- Molecular weight
- 179.01
Names & synonyms
prop-2-enyl 2-bromoacetateRefChem:868624689-243-7Allyl bromoacetateallyl 2-bromoacetate40630-84-0MFCD16620537PROP-2-EN-1-YL 2-BROMOACETATEAcetic acid, 2-bromo-, 2-propen-1-yl ester2-Bromo-acetic Acid 2-Propen-1-yl Esterbromoacetic acid allyl esterbromo-acetic acid allyl ester
Show more names
2-Bromoacrylic acid allyl ester
Prop-2-en-1-yl bromoacetateSCHEMBL299657DTXSID10335850AKOS040768608Acetic acid, bromo-, 2-propenyl esterAS-93614SY278551DB-208209
Database identifiers
- CAS
40630-84-0- PubChem CID
- 527610
- DTXSID
DTXSID10335850- EC Number
- 689-243-7
- Nikkaji
- J1.333.200B
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 8
- Formal charge
- 0
- Complexity
- 90.4
Physicochemical properties
- Boiling point
- 73 °C · 73 °C(Press: 10 Torr)
- Density
- 1.4329 g/cm3 · 1.4329 g/cm3
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 312 · H312-H302-H332-H319-H335-H315
- Precautionary statements
- 261 · P261-P271-P304+P340-P312-P264-P270-P301+P312-P330-P501-P280-P302+P352-P312-P322-P363-P501-P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362
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 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
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.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H312-H302-H332-H319-H335-H315
- Precautionary statements
- P261-P271-P304+P340-P312-P264-P270-P301+P312-P330-P501-P280-P302+P352-P312-P322-P363-P501-P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362
Chemistry & industry
Applications
Uses2-Bromo-acetic Acid 2-Propen-1-yl Ester is used in the treatment of leishmaniasis.
Upstream & downstream products
Downstream products
Suppliers27 total
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]
江苏艾康生物医药研发有限公司025-66061636 19370895928 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
南京世洲生物科技有限公司025-025-85560043 17301488900 · [email protected]
上海凯曼化工科技有限公司021-021-50400622 15618790390 · [email protected]
Hangzhou Sage Chemical Co., Ltd.+86057186818502 13588463833 · [email protected]
烟台盛凯伦生物制品有限公司13356901049 · [email protected]
河南阿尔法化工有限公司0371-55013243 15324716602 · [email protected]
无锡丽恒昇生物医药科技有限公司15250805028 15250805028 · [email protected]
Related reactions
12 records
Compound notes
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