9-bromocarbazol-1-ol

C12H8BrNO — CID 118380474

IUPAC9-bromocarbazol-1-ol
SMILESOc1cccc2c3ccccc3n(Br)c12
InChIInChI=1S/C12H8BrNO/c13-14-10-6-2-1-4-8(10)9-5-3-7-11(15)12(9)14/h1-7,15H
InChIKeySYMBVQLFYAHJFS-UHFFFAOYSA-N
MW262.11 g/mol
LogP3.66
Rot. Bonds

About 9-bromocarbazol-1-ol

9-bromocarbazol-1-ol (PubChem CID 118380474) has the molecular formula C12H8BrNO and a molecular weight of 262.11 g/mol. Its IUPAC name is 9-bromocarbazol-1-ol.

Molecular Properties

Compound Name9-bromocarbazol-1-ol
PubChem CID118380474
Molecular FormulaC12H8BrNO
Molecular Weight262.11 g/mol
Exact Mass260.98
IUPAC Name9-bromocarbazol-1-ol
SMILESOc1cccc2c3ccccc3n(Br)c12
InChIInChI=1S/C12H8BrNO/c13-14-10-6-2-1-4-8(10)9-5-3-7-11(15)12(9)14/h1-7,15H
InChIKeySYMBVQLFYAHJFS-UHFFFAOYSA-N
XLogP3.66
TPSA25.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.11
LogP ≤ 53.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 9-bromocarbazol-1-ol?
The IUPAC name of 9-bromocarbazol-1-ol (CID 118380474) is 9-bromocarbazol-1-ol.
What is the SMILES notation for 9-bromocarbazol-1-ol?
The canonical SMILES for 9-bromocarbazol-1-ol is Oc1cccc2c3ccccc3n(Br)c12.
What is the InChIKey of 9-bromocarbazol-1-ol?
The InChIKey is SYMBVQLFYAHJFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H8BrNO/c13-14-10-6-2-1-4-8(10)9-5-3-7-11(15)12(9)14/h1-7,15H.
What are the key properties of 9-bromocarbazol-1-ol?
9-bromocarbazol-1-ol has a molecular weight of 262.11 g/mol, XLogP of 3.66, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9-bromocarbazol-1-ol is sourced from PubChem (CID 118380474), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).