(4-bromo-6-fluoro-2,3-dihydro-1H-inden-1-yl)methanol

C10H10BrFO — CID 130114202

IUPAC(4-bromo-6-fluoro-2,3-dihydro-1H-inden-1-yl)methanol
SMILESOCC1CCc2c(Br)cc(F)cc21
InChIInChI=1S/C10H10BrFO/c11-10-4-7(12)3-9-6(5-13)1-2-8(9)10/h3-4,6,13H,1-2,5H2
InChIKeyMKIQARZPIXSPCH-UHFFFAOYSA-N
MW245.09 g/mol
LogP2.61
Rot. Bonds1

About (4-bromo-6-fluoro-2,3-dihydro-1H-inden-1-yl)methanol

(4-bromo-6-fluoro-2,3-dihydro-1H-inden-1-yl)methanol (PubChem CID 130114202) has the molecular formula C10H10BrFO and a molecular weight of 245.09 g/mol. Its IUPAC name is (4-bromo-6-fluoro-2,3-dihydro-1H-inden-1-yl)methanol.

Molecular Properties

Compound Name(4-bromo-6-fluoro-2,3-dihydro-1H-inden-1-yl)methanol
PubChem CID130114202
Molecular FormulaC10H10BrFO
Molecular Weight245.09 g/mol
Exact Mass243.99
IUPAC Name(4-bromo-6-fluoro-2,3-dihydro-1H-inden-1-yl)methanol
SMILESOCC1CCc2c(Br)cc(F)cc21
InChIInChI=1S/C10H10BrFO/c11-10-4-7(12)3-9-6(5-13)1-2-8(9)10/h3-4,6,13H,1-2,5H2
InChIKeyMKIQARZPIXSPCH-UHFFFAOYSA-N
XLogP2.61
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.09
LogP ≤ 52.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze (4-bromo-6-fluoro-2,3-dihydro-1H-inden-1-yl)methanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-bromo-6-fluoro-2,3-dihydro-1H-inden-1-amine;hydrochloride
CID 167722097
2-(4-bromo-6-fluorooxy-2,3-dihydro-1H-inden-1-yl)acetic acid
CID 67720113
(1R)-5-fluoro-1-(hydroxymethyl)-2,3-dihydro-1H-indene-4-carbonitrile
CID 124560327
2-bromo-4-fluoro-6-piperidin-4-ylphenol
CID 84713813
(4R)-8-bromo-6-fluoro-3,4-dihydro-1H-isothiochromen-4-amine
CID 82887038
(1S)-1-amino-6-fluoro-2,3-dihydro-1H-inden-4-ol
CID 130639484
(6-fluoro-1,2,3,4-tetrahydroquinolin-4-yl)methanol
CID 83752790
(3-bromo-2-cyclopropyloxy-5-fluorophenyl)methanol
CID 84710384
(2,6-dibromo-4-fluorophenyl)methanol
CID 58043943
2-(azetidin-2-yl)-6-bromo-4-fluorophenol
CID 131124098
2-[(2R)-azetidin-2-yl]-6-bromo-4-fluorophenol
CID 130983518
2-(6-bromo-4-fluoro-2,3-dihydro-1H-inden-1-yl)acetonitrile
CID 130114251

Frequently Asked Questions

What is the IUPAC name of (4-bromo-6-fluoro-2,3-dihydro-1H-inden-1-yl)methanol?
The IUPAC name of (4-bromo-6-fluoro-2,3-dihydro-1H-inden-1-yl)methanol (CID 130114202) is (4-bromo-6-fluoro-2,3-dihydro-1H-inden-1-yl)methanol.
What is the SMILES notation for (4-bromo-6-fluoro-2,3-dihydro-1H-inden-1-yl)methanol?
The canonical SMILES for (4-bromo-6-fluoro-2,3-dihydro-1H-inden-1-yl)methanol is OCC1CCc2c(Br)cc(F)cc21.
What is the InChIKey of (4-bromo-6-fluoro-2,3-dihydro-1H-inden-1-yl)methanol?
The InChIKey is MKIQARZPIXSPCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10BrFO/c11-10-4-7(12)3-9-6(5-13)1-2-8(9)10/h3-4,6,13H,1-2,5H2.
What are the key properties of (4-bromo-6-fluoro-2,3-dihydro-1H-inden-1-yl)methanol?
(4-bromo-6-fluoro-2,3-dihydro-1H-inden-1-yl)methanol has a molecular weight of 245.09 g/mol, XLogP of 2.61, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (4-bromo-6-fluoro-2,3-dihydro-1H-inden-1-yl)methanol is sourced from PubChem (CID 130114202), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).