Basic information
- CAS
1187928-44-4- Standard SMILES
Brc1ccc(-c2nc3c(o2)CNCC3)cc1.Cl- InChIKey
QVBILZSHNPBRTO-UHFFFAOYSA-N- Molecular formula
- C12H12BrClN2O
- Average molar mass
- 315.59 g/mol
- Monoisotopic mass
- 313.98215
Names & identifiers
- Preferred name
- 2-(4-Bromophenyl)-4,5,6,7-tetrahydrooxazolo[5,4-c]pyridine hydrochloride
- IUPAC
- 2-(4-bromophenyl)-4,5,6,7-tetrahydro-[1,3]oxazolo[5,4-c]pyridine;hydrochloride
- English name
- 2-(4-Bromo-phenyl)-4,5,6,7-tetrahydro-oxazolo[5,4-c]pyridine hydrochloride
- Molecular formula
- C12H12BrClN2O
- Molecular weight
- 315.6
Names & synonyms
1187928-44-42-(4-Bromophenyl)-4,5,6,7-tetrahydrooxazolo[5,4-c]pyridine hydrochloride2-(4-Bromo-phenyl)-4,5,6,7-tetrahydro-oxazolo[5,4-c]pyridine hydrochlorideMFCD115061712-(4-bromo-phenyl)-4,5,6,7-tetrahydro-oxazolo[5,4-c]pyridine hcl2-(4-bromophenyl)-4,5,6,7-tetrahydro-[1,3]oxazolo[5,4-c]pyridine;hydrochlorideAKOS024262613SB31208AS-30423CS-03350912-(4-bromophenyl)-4,5,6,7-tetrahydrooxazolo[5,4-c]pyridine;hydrochloride2-(4-Bromophenyl)-4,5,6,7-tetrahydrooxazolo[5,4-c]pyridinehydrochloride
Database identifiers
- CAS
1187928-44-4- PubChem CID
- 74889672
Properties
Computed structural properties
- Topological polar surface area
- 38.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 243
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P280-P301+P312-P302+P352-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.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P280-P301+P312-P302+P352-P305+P351+P338
Chemistry & industry
Suppliers7 total
安徽合诺生物科技有限公司0555-2761852
安徽合诺生物科技有限公司18455579438
杰达维（上海）医药科技发展有限公司/J & W PharmLab021-64340559 · [email protected]
上海书亚医药科技有限公司400-685-9117 · [email protected]
金锦乐(湖南)化学有限公司18001959627(微信同号) 18001959627 · [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]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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