Ethanol, 1-(3-bromo-2-thienyl)-2-isopropylamino-
Basic information
- CAS
67226-96-4- Standard SMILES
CC(C)NCC(O)c1sccc1Br- InChIKey
AJSLWOJNFFUMQE-UHFFFAOYSA-N- Molecular formula
- C9H14BrNOS
- Average molar mass
- 264.18 g/mol
- Monoisotopic mass
- 262.99795
Names & identifiers
- Preferred name
- Ethanol, 1-(3-bromo-2-thienyl)-2-isopropylamino-
- IUPAC
- 1-(3-bromothiophen-2-yl)-2-(propan-2-ylamino)ethanol
- English name
- 1-(3-Bromo-2-thienyl)-2-isopropylaminoethanol
- Molecular formula
- C9H14BrNOS
- Molecular weight
- 264.18
Names & synonyms
1-(3-Bromo-2-thienyl)-2-isopropylaminoethanolBRN 137062967226-96-4Ethanol, 1-(3-bromo-2-thienyl)-2-isopropylamino-3-Bromo-alpha-(isopropylaminomethyl)-2-thiophenemethanol2-Thiophenemethanol, 3-bromo-alpha-(isopropylaminomethyl)-RefChem:340645CHEMBL3248408DTXSID209863371-(3-Bromothiophen-2-yl)-2-[(propan-2-yl)amino]ethan-1-olAKOS0190387812-Thiophenemethanol, 3-bromo-α-[[(1-methylethyl)amino]methyl]-
Database identifiers
- CAS
67226-96-4- PubChem CID
- 3050992
- DTXSID
DTXSID20986337- ChEMBL
CHEMBL3248408- Nikkaji
- J92.934D
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 60.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 157
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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