3-bromo-1-(hydroxymethyl)-9H-fluoren-9-ol

C14H11BrO2 — CID 15661437

IUPAC3-bromo-1-(hydroxymethyl)-9H-fluoren-9-ol
SMILESOCc1cc(Br)cc2c1C(O)c1ccccc1-2
InChIInChI=1S/C14H11BrO2/c15-9-5-8(7-16)13-12(6-9)10-3-1-2-4-11(10)14(13)17/h1-6,14,16-17H,7H2
InChIKeyFAPNBOPHCWFDDW-UHFFFAOYSA-N
MW291.14 g/mol
LogP3.00
Rot. Bonds1

About 3-bromo-1-(hydroxymethyl)-9H-fluoren-9-ol

3-bromo-1-(hydroxymethyl)-9H-fluoren-9-ol (PubChem CID 15661437) has the molecular formula C14H11BrO2 and a molecular weight of 291.14 g/mol. Its IUPAC name is 3-bromo-1-(hydroxymethyl)-9H-fluoren-9-ol.

Molecular Properties

Compound Name3-bromo-1-(hydroxymethyl)-9H-fluoren-9-ol
PubChem CID15661437
Molecular FormulaC14H11BrO2
Molecular Weight291.14 g/mol
Exact Mass289.99
IUPAC Name3-bromo-1-(hydroxymethyl)-9H-fluoren-9-ol
SMILESOCc1cc(Br)cc2c1C(O)c1ccccc1-2
InChIInChI=1S/C14H11BrO2/c15-9-5-8(7-16)13-12(6-9)10-3-1-2-4-11(10)14(13)17/h1-6,14,16-17H,7H2
InChIKeyFAPNBOPHCWFDDW-UHFFFAOYSA-N
XLogP3.00
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.14
LogP ≤ 53.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 13330208
(1S)-5-bromo-2,3-dihydro-1H-inden-1-ol
CID 29414737
(1R)-5-bromo-2,3-dihydro-1H-inden-1-ol
CID 29414734
(1R)-4-bromo-2,3-dihydro-1H-inden-1-ol
CID 51915875
2-Bromo-9-(trifluoromethyl)fluoren-9-ol
CID 59492587
5-bromo-2,3-dihydro-1H-inden-1-ol
CID 13486299
(1S)-4-bromo-2,3-dihydro-1H-inden-1-ol
CID 51915874
7-Bromo-2,3-dihydro-1H-inden-1-ol
CID 58306680
(6-bromo-2,3-dihydro-1H-inden-5-yl)methanol
CID 155978340
[4-Bromo-2-[[2-(hydroxymethyl)phenyl]methyl]phenyl]methanol
CID 11278213
4,4'-Dibromo-2,2'-bis-hydroxymethyl-biphenyl
CID 11372175
9-(4-bromophenyl)-9H-fluoren-9-ol
CID 13460626

Frequently Asked Questions

What is the IUPAC name of 3-bromo-1-(hydroxymethyl)-9H-fluoren-9-ol?
The IUPAC name of 3-bromo-1-(hydroxymethyl)-9H-fluoren-9-ol (CID 15661437) is 3-bromo-1-(hydroxymethyl)-9H-fluoren-9-ol.
What is the SMILES notation for 3-bromo-1-(hydroxymethyl)-9H-fluoren-9-ol?
The canonical SMILES for 3-bromo-1-(hydroxymethyl)-9H-fluoren-9-ol is OCc1cc(Br)cc2c1C(O)c1ccccc1-2.
What is the InChIKey of 3-bromo-1-(hydroxymethyl)-9H-fluoren-9-ol?
The InChIKey is FAPNBOPHCWFDDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11BrO2/c15-9-5-8(7-16)13-12(6-9)10-3-1-2-4-11(10)14(13)17/h1-6,14,16-17H,7H2.
What are the key properties of 3-bromo-1-(hydroxymethyl)-9H-fluoren-9-ol?
3-bromo-1-(hydroxymethyl)-9H-fluoren-9-ol has a molecular weight of 291.14 g/mol, XLogP of 3.00, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-bromo-1-(hydroxymethyl)-9H-fluoren-9-ol is sourced from PubChem (CID 15661437), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).