4'-Bromo[1,1'-biphenyl]-2-carboxylic acid
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Basic information
- CAS
37174-65-5- Standard SMILES
O=C(O)c1ccccc1-c1ccc(Br)cc1- InChIKey
NTCVMUBIEDDKML-UHFFFAOYSA-N- Molecular formula
- C13H9BrO2
- Average molar mass
- 277.11 g/mol
- Monoisotopic mass
- 275.97859
Names & identifiers
- Preferred name
- 4'-Bromo[1,1'-biphenyl]-2-carboxylic acid
- IUPAC
- 2-(4-bromophenyl)benzoic acid
- English name
- 2-BIPHENYL-4'-BROMO-CARBOXYLIC ACID
- Molecular formula
- C13H9BrO2
- Molecular weight
- 277.11
Names & synonyms
37174-65-5DTXSID605454274'-Bromo[1,1'-biphenyl]-2-carboxylic acid4'-Bromo(1,1'-biphenyl)-2-carboxylic acidRefChem:283386DTXCID904962114'-bromobiphenyl-2-carboxylic acid2-Biphenyl-4'-bromo-carboxylic acid2-(4-bromophenyl)benzoic acid4'-Bromo-[1,1'-biphenyl]-2-carboxylic acidMFCD038399624'-Bromo-[1,1'-biphenyl]-2-carboxylicacid
Show more names
4'-Bromo-1,1'-biphenyl-2-carboxylic acid
4'-bromo-biphenyl-2-carboxylic acid4'-Bromobiphenyl-2-carboxylicacid4-bromophenylbenzoic acidSCHEMBL3416936NTCVMUBIEDDKML-UHFFFAOYSA-N2-Biphenyl-4'-bromocarboxylic acidAKOS013202402AC-6462
Database identifiers
- CAS
37174-65-5- PubChem CID
- 13629283
- DTXSID
DTXSID60545427- EC Number
- 675-755-8
- Nikkaji
- J325.065B
Properties
Computed structural propertiesFilling in
- XLogP
- 3.6
- Topological polar surface area
- 37.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 246
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-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
- P261-P305+P351+P338
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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