2-(5-Bromo-2-chlorophenyl)-1,3-benzoxazol-5-ylamine
Basic information
- CAS
293737-86-7- Standard SMILES
Nc1ccc2oc(-c3cc(Br)ccc3Cl)nc2c1- InChIKey
VHHFGVFUDZMDCD-UHFFFAOYSA-N- Molecular formula
- C13H8BrClN2O
- Average molar mass
- 323.57 g/mol
- Monoisotopic mass
- 321.95085
Names & identifiers
- Preferred name
- 2-(5-Bromo-2-chlorophenyl)-1,3-benzoxazol-5-ylamine
- IUPAC
- 2-(5-bromo-2-chlorophenyl)-1,3-benzoxazol-5-amine
- English name
- 2-(5-BROMO-2-CHLORO-PHENYL)-BENZOOXAZOL-5-YLAMINE
- Molecular formula
- C13H8BrClN2O
- Molecular weight
- 323.57
Names & synonyms
2-(5-bromo-2-chlorophenyl)-1,3-benzoxazol-5-ylamineRefChem:458651657-456-42-(5-bromo-2-chlorophenyl)-1,3-benzoxazol-5-amine293737-86-72-(5-bromo-2-chlorophenyl)benzo[d]oxazol-5-amineMFCD01145121MLS000036810DTXSID50349754SMR0000367372-(5-bromo-2-chlorophenyl)benzoxazole-5-ylamine5-Benzoxazolamine, 2-(5-bromo-2-chlorophenyl)-
Show more names
AKOS BB-8070ASISCHEM B52450ART-CHEM-BB B025147TIMTEC-BB SBB0137362-(5-BROMO-2-CHLOROPHENYL)-5-BENZOXAZOLAMINE
C13H8BrClN2O2-(5-BROMO-2-CHLORO-PHENYL)-BENZOOXAZOL-5-YLAMINEcid_659499SCHEMBL2490857CHEMBL1349625BDBM39089VHHFGVFUDZMDCD-UHFFFAOYSA-NHMS2441I09
Database identifiers
- CAS
293737-86-7- PubChem CID
- 659499
- DTXSID
DTXSID50349754- ChEMBL
CHEMBL1349625- EC Number
- 657-456-4
Properties
Computed structural properties
- XLogP
- 4.1
- Topological polar surface area
- 52.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 307
Physicochemical properties
- Symbol(GHS)
- 6 · GHS06
- Signal word
- Danger
- Hazard statements
- 301 · H301-H413-H319
- Precautionary statements
- 264 · P264-P270-P301+P310-P321-P330-P405-P501-P264-P280-P305+P351+P338-P337+P313P
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
Danger
H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]
P264, P264+P265, P270, P273, P280, P301+P316, P305+P351+P338, P321, P330, P337+P317, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 38 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesAcute Tox. 3 (100%)
Safety data
- Signal word
- Danger
- Symbol(GHS)
- GHS06
- Hazard statements
- H301-H413-H319
- Precautionary statements
- P264-P270-P301+P310-P321-P330-P405-P501-P264-P280-P305+P351+P338-P337+P313P
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Compound notes
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