Basic information
- CAS
4239-10-5- Standard SMILES
CS(=O)(=O)OCCBr- InChIKey
ZUAJICINWDWGQN-UHFFFAOYSA-N- Molecular formula
- C3H7BrO3S
- Average molar mass
- 203.06 g/mol
- Monoisotopic mass
- 201.92993
Names & identifiers
- Preferred name
- 2-Bromoethyl methanesulfonate
- IUPAC
- 2-bromoethyl methanesulfonate
- English name
- Methanesulfonic acid 2-bromoethyl ester
- Molecular formula
- C3H7BrO3S
- Molecular weight
- 203.05
Names & synonyms
2-Bromoethyl methanesulfonateEthanol, 2-bromo-, methanesulfonateMethanesulfonic acid, 2-bromoethyl esterDTXSID90195196NSC 49551AI3-50048RefChem:85870DTXCID00117687959-456-2ZUAJICINWDWGQN-UHFFFAOYSA-N4239-10-5Bromoethyl methanesulfonate
Show more names
Br-PEG1-MsMethanesulfonic acid 2-bromoethylEthanol, 2-bromo-, 1-methanesulfonate
NSC-49551Methanesulfonic acid 2-bromoethyl ester2-Bromoethyl mesylateHTM4Z2M8SNCHEMBL16990SCHEMBL1934930NSC49551MFCD20483903
Database identifiers
- CAS
4239-10-5- PubChem CID
- 96042
- DTXSID
DTXSID90195196- ChEMBL
CHEMBL16990- UNII
- HTM4Z2M8SN
- EC Number
- 959-456-2
- Nikkaji
- J908C
Properties
Computed structural properties
- XLogP
- 0.4
- Topological polar surface area
- 51.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 8
- Formal charge
- 0
- Complexity
- 133
Physicochemical properties
- Boiling point
- 126 · 126-128 °C(Press: 5 Torr)
- Density
- 1.711 · 1.711±0.06 g/cm3(Predicted)
- FDA UNII
- 4 Z2M8SN · HTM4Z2M8SN
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
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]
P203, P261, P264, P270, P271, P280, P301+P317, P302+P352, P304+P340, P317, P318, P321, P330, P362+P364, 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
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Upstream & downstream products
Downstream products
Suppliers11 total
南京世洲生物科技有限公司025-025-85560043 17301488900 · [email protected]
吉林中科研伸科技有限公司18143011203 · [email protected]
吉林中科研伸科技有限公司0431-80514535 19917294565 · [email protected]
深圳振强药物研发有限公司+86-0755-66853366 +86-13670046396 · [email protected]
Xian confluore Biological Technology Co., Ltd.+86-15680926068 · [email protected]
常州峰海医药科技有限公司13685290895 · [email protected]
北京爱科姆科技有限公司17710328343 · [email protected]
西安康福诺生物科技有限公司+86-156-80926068 +86-15680926068 · [email protected]
陕西缔都医药化工有限公司+86-29-81139210 17389186172 · [email protected]
Jilin Chinese Academy of Sciences-yanshen Technology18143011203 · [email protected]
南京世洲生物科技有限公司025-85560043 13675144456 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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