9H-carbazole-1,3,6,8-tetrol

C12H9NO4 — CID 68824527

IUPAC9H-carbazole-1,3,6,8-tetrol
SMILESOc1cc(O)c2[nH]c3c(O)cc(O)cc3c2c1
InChIInChI=1S/C12H9NO4/c14-5-1-7-8-2-6(15)4-10(17)12(8)13-11(7)9(16)3-5/h1-4,13-17H
InChIKeyYQDVWPYDOMAQIU-UHFFFAOYSA-N
MW231.21 g/mol
LogP2.14
Rot. Bonds

About 9H-carbazole-1,3,6,8-tetrol

9H-carbazole-1,3,6,8-tetrol (PubChem CID 68824527) has the molecular formula C12H9NO4 and a molecular weight of 231.21 g/mol. Its IUPAC name is 9H-carbazole-1,3,6,8-tetrol.

Molecular Properties

Compound Name9H-carbazole-1,3,6,8-tetrol
PubChem CID68824527
Molecular FormulaC12H9NO4
Molecular Weight231.21 g/mol
Exact Mass231.05
IUPAC Name9H-carbazole-1,3,6,8-tetrol
SMILESOc1cc(O)c2[nH]c3c(O)cc(O)cc3c2c1
InChIInChI=1S/C12H9NO4/c14-5-1-7-8-2-6(15)4-10(17)12(8)13-11(7)9(16)3-5/h1-4,13-17H
InChIKeyYQDVWPYDOMAQIU-UHFFFAOYSA-N
XLogP2.14
TPSA96.71 Ų
H-Bond Donors5
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.21
LogP ≤ 52.14
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 104

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Related Compounds

9H-carbazole-1,3,5,7-tetrol
CID 171714982
9H-carbazole-1,3,4,8-tetrol
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9H-carbazole-1,2,3,5,6,8-hexol
CID 171715050
benzene-1,3,5-triol
CID 359
3,4-dimethyl-9H-carbazole-1,8-diol
CID 171715160
2-[2,4-dihydroxy-3-(2,4,6-trihydroxyphenyl)cyclobutyl]benzene-1,3,5-triol
CID 20730795
4-chloro-2-hydroxy-5H-phenanthridin-6-one;hydrochloride
CID 175751706
3-hydroxy-9H-carbazole-1-carboxylic acid
CID 154084192
CID 70471879
CID 70471879
2-[2-(2,4,6-trihydroxyphenyl)ethyl]benzene-1,3,5-triol
CID 90416964
2-[(E)-2-(2,4,6-trihydroxyphenyl)ethenyl]benzene-1,3,5-triol
CID 10221223
2-[(2,4,6-trihydroxyphenyl)diazenyl]benzene-1,3,5-triol
CID 159009419

Frequently Asked Questions

What is the IUPAC name of 9H-carbazole-1,3,6,8-tetrol?
The IUPAC name of 9H-carbazole-1,3,6,8-tetrol (CID 68824527) is 9H-carbazole-1,3,6,8-tetrol.
What is the SMILES notation for 9H-carbazole-1,3,6,8-tetrol?
The canonical SMILES for 9H-carbazole-1,3,6,8-tetrol is Oc1cc(O)c2[nH]c3c(O)cc(O)cc3c2c1.
What is the InChIKey of 9H-carbazole-1,3,6,8-tetrol?
The InChIKey is YQDVWPYDOMAQIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9NO4/c14-5-1-7-8-2-6(15)4-10(17)12(8)13-11(7)9(16)3-5/h1-4,13-17H.
What are the key properties of 9H-carbazole-1,3,6,8-tetrol?
9H-carbazole-1,3,6,8-tetrol has a molecular weight of 231.21 g/mol, XLogP of 2.14, 0 rotatable bonds, 5 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 9H-carbazole-1,3,6,8-tetrol is sourced from PubChem (CID 68824527), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).