Basic information
- CAS
824933-40-6- Standard SMILES
O=C(O)COc1ccc2c(c1)CCc1c-2[nH]c2ccc(Br)cc12- InChIKey
LNDSXMCSZZEFAY-UHFFFAOYSA-N- Molecular formula
- C18H14BrNO3
- Average molar mass
- 372.2 g/mol
- Monoisotopic mass
- 371.01571
Names & identifiers
- Preferred name
- [(8-Bromo-6,11-dihydro-5H-benzo[a]carbazol-3-yl)oxy]acetic acid
- IUPAC
- 2-[(8-bromo-6,11-dihydro-5H-benzo[a]carbazol-3-yl)oxy]acetic acid
Names & synonyms
824933-40-6DTXSID00837757[(8-Bromo-6,11-dihydro-5H-benzo[a]carbazol-3-yl)oxy]acetic acid
Database identifiers
- CAS
824933-40-6- PubChem CID
- 71418445
- DTXSID
DTXSID00837757
Properties
Computed structural properties
- XLogP
- 4.3
- Topological polar surface area
- 62.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 460
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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