(4R)-8-chloro-5-fluoro-3,4-dihydro-2H-chromen-4-ol

C9H8ClFO2 — CID 130501634

IUPAC(4R)-8-chloro-5-fluoro-3,4-dihydro-2H-chromen-4-ol
SMILESO[C@@H]1CCOc2c(Cl)ccc(F)c21
InChIInChI=1S/C9H8ClFO2/c10-5-1-2-6(11)8-7(12)3-4-13-9(5)8/h1-2,7,12H,3-4H2/t7-/m1/s1
InChIKeyZOJJHNQSOCPWSZ-SSDOTTSWSA-N
MW202.61 g/mol
LogP2.30
Rot. Bonds

About (4R)-8-chloro-5-fluoro-3,4-dihydro-2H-chromen-4-ol

(4R)-8-chloro-5-fluoro-3,4-dihydro-2H-chromen-4-ol (PubChem CID 130501634) has the molecular formula C9H8ClFO2 and a molecular weight of 202.61 g/mol. Its IUPAC name is (4R)-8-chloro-5-fluoro-3,4-dihydro-2H-chromen-4-ol.

Molecular Properties

Compound Name(4R)-8-chloro-5-fluoro-3,4-dihydro-2H-chromen-4-ol
PubChem CID130501634
Molecular FormulaC9H8ClFO2
Molecular Weight202.61 g/mol
Exact Mass202.02
IUPAC Name(4R)-8-chloro-5-fluoro-3,4-dihydro-2H-chromen-4-ol
SMILESO[C@@H]1CCOc2c(Cl)ccc(F)c21
InChIInChI=1S/C9H8ClFO2/c10-5-1-2-6(11)8-7(12)3-4-13-9(5)8/h1-2,7,12H,3-4H2/t7-/m1/s1
InChIKeyZOJJHNQSOCPWSZ-SSDOTTSWSA-N
XLogP2.30
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.61
LogP ≤ 52.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (4R)-8-chloro-5-fluoro-3,4-dihydro-2H-chromen-4-ol 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

5-fluoro-8-methyl-3,4-dihydro-2H-chromen-4-ol
CID 102990727
(4S)-8-chloro-5-fluoro-3,4-dihydro-2H-chromen-4-amine;hydrochloride
CID 171252255
(4S)-5,6,8-trichloro-3,4-dihydro-2H-chromen-4-ol
CID 79014196
4-fluoro-7-methyl-2,3-dihydro-1-benzofuran-3-ol
CID 102990724
5,8-difluoro-3,4-dihydro-2H-chromen-4-amine
CID 59704967
8-chloro-5-fluoro-2,3-dihydrochromen-4-one;hydrochloride
CID 127263941
(4R)-6-chloro-7-fluoro-3,4-dihydro-2H-chromen-4-ol
CID 82717481
(4R)-5-bromo-7,8-difluoro-3,4-dihydro-2H-chromen-4-ol
CID 107102402
(4R)-8-chloro-5,6-difluoro-3,4-dihydro-2H-chromen-4-amine
CID 131151157
4-(4-chlorophenyl)sulfonyl-5,8-difluoro-3,4-dihydro-2H-chromene;methanol
CID 143513714
6-chloro-3,4-dihydro-2H-chromen-4-ol
CID 15148408
(4R)-7-chloro-3,4-dihydro-2H-chromen-4-ol
CID 79002138

Frequently Asked Questions

What is the IUPAC name of (4R)-8-chloro-5-fluoro-3,4-dihydro-2H-chromen-4-ol?
The IUPAC name of (4R)-8-chloro-5-fluoro-3,4-dihydro-2H-chromen-4-ol (CID 130501634) is (4R)-8-chloro-5-fluoro-3,4-dihydro-2H-chromen-4-ol.
What is the SMILES notation for (4R)-8-chloro-5-fluoro-3,4-dihydro-2H-chromen-4-ol?
The canonical SMILES for (4R)-8-chloro-5-fluoro-3,4-dihydro-2H-chromen-4-ol is O[C@@H]1CCOc2c(Cl)ccc(F)c21.
What is the InChIKey of (4R)-8-chloro-5-fluoro-3,4-dihydro-2H-chromen-4-ol?
The InChIKey is ZOJJHNQSOCPWSZ-SSDOTTSWSA-N. The full InChI is InChI=1S/C9H8ClFO2/c10-5-1-2-6(11)8-7(12)3-4-13-9(5)8/h1-2,7,12H,3-4H2/t7-/m1/s1.
What are the key properties of (4R)-8-chloro-5-fluoro-3,4-dihydro-2H-chromen-4-ol?
(4R)-8-chloro-5-fluoro-3,4-dihydro-2H-chromen-4-ol has a molecular weight of 202.61 g/mol, XLogP of 2.30, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-8-chloro-5-fluoro-3,4-dihydro-2H-chromen-4-ol is sourced from PubChem (CID 130501634), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).