Basic information
- CAS
83800-98-0- Standard SMILES
Clc1nc(-c2ccc(Br)cc2)nc2ccccc12- InChIKey
LWOVKRLBRZYBQV-UHFFFAOYSA-N- Molecular formula
- C14H8BrClN2
- Average molar mass
- 319.58 g/mol
- Monoisotopic mass
- 317.95594
Names & identifiers
- Preferred name
- 2-(4-Bromophenyl)-4-chloroquinazoline
- IUPAC
- 2-(4-bromophenyl)-4-chloroquinazoline
- English name
- 2-(4-BROMO-PHENYL)-4-CHLORO-QUINAZOLINE
- Molecular formula
- C14H8BrClN2
- Molecular weight
- 319.58
Names & synonyms
2-(4-bromophenyl)-4-chloroquinazoline83800-98-0DTXSID00358472RefChem:252021DTXCID203095272-(4-BROMO-PHENYL)-4-CHLORO-QUINAZOLINEMFCD016474422-(4-bromophenyl)-4-chloro-quinazolineSCHEMBL5793174IDA80098AB09634AT17385
Show more names
2-(4-Bromo-phenyl)-4-chloro-quizolineQuinazoline, 2-(4-bromophenyl)-4-chloro-
CS-0341152AJ-292/11896042EN300-18582264Z3243653062
Database identifiers
- CAS
83800-98-0- PubChem CID
- 899321
- DTXSID
DTXSID00358472- EC Number
- 169-810-0
- Nikkaji
- J2.571.690F
Properties
Computed structural properties
- XLogP
- 5.2
- Topological polar surface area
- 25.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 281
Physicochemical properties
- Boiling point
- 342.2 · 342.2±34.0 °C(Predicted)
- Density
- 1.571 · 1.571±0.06 g/cm3(Predicted)
- pka
- 0.27 · 0.27±0.30(Predicted)
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, 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%)
Chemistry & industry
Suppliers12 total
西安美科生物科技有限公司029-18710438009 18710438009 · [email protected]
杰达维（上海）医药科技发展有限公司/J & W PharmLab021-64340559 · [email protected]
上海任跃化学科技有限公司021-62219190; 18321139117 · [email protected]
江阴康源生物医药科技有限公司0510-86010668 13395169561 · [email protected]
上海安米克化学品有限公司微信 18019252918 18019252918 · [email protected]
苏州爱玛特生物科技有限公司0512-56316828 400-867-5858;400-867-5858 · [email protected]
砌块化学科技（上海）有限公司021-20432219 13918097649 · [email protected]
上海智乾生物科技有限公司[email protected]
郑州汇聚化工有限公司037155153829 18003835034 · [email protected]
南京世洲生物科技有限公司13675144456 · [email protected]
陕西缔都化学有限公司17691182729 17392216275 · [email protected]
吉林中科研伸科技有限公司043180534350 19917294565 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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