Basic information
- CAS
34457-01-7- Standard SMILES
Cc1ccccc1C(C)Br- InChIKey
LKNZNIHNBFZDQM-UHFFFAOYSA-N- Molecular formula
- C9H11Br
- Average molar mass
- 199.09 g/mol
- Monoisotopic mass
- 198.00441
Names & identifiers
- Preferred name
- 1-(1-Bromoethyl)-2-methylbenzene
- IUPAC
- 1-(1-bromoethyl)-2-methylbenzene
- English name
- 1-Bromoethyl-2-methylbenzene
- Molecular formula
- C9H11Br
- Molecular weight
- 199.09
Names & synonyms
1-(1-bromoethyl)-2-methylbenzene34457-01-7DTXSID101303175RefChem:419674DTXCID501733221999-984-01-Bromoethyl-2-methylbenzeneSCHEMBL624799SCHEMBL10369884SCHEMBL29403593JBA457011-(1-bromoethyl)-2-methyl-benzene
Show more names
Benzene, 1-(1-bromoethyl)-2-methyl-
MFCD11103124DB-089044EN300-111330A1-42138
Database identifiers
- CAS
34457-01-7- PubChem CID
- 13682011
- DTXSID
DTXSID101303175- EC Number
- 999-984-0
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 1
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 101
Physicochemical properties
- Boiling point
- 220.7 · 220.7±9.0 °C(Predicted)
- Density
- 1.305 · 1.305±0.06 g/cm3(Predicted)
- 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
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, 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 CategoriesSkin Irrit. 2 (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
Upstream raw materials
Suppliers5 total
砌块化学科技（上海）有限公司021-20432219 13918097649 · [email protected]
郑州为易化工产品有限公司0371-88888888 qq272369594;2159423853qq · [email protected]
上海景容化学科技有限公司021-60546673 13701861782 · [email protected]
珠海奥博凯生物医药技术有限公司400-0628126 · [email protected]
北京新研汇医药研发有限公司13969155946 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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