6-chloro-8-fluoro-4-methyl-3,4-dihydro-2H-chromene

C10H10ClFO — CID 175804511

IUPAC6-chloro-8-fluoro-4-methyl-3,4-dihydro-2H-chromene
SMILESCC1CCOc2c(F)cc(Cl)cc21
InChIInChI=1S/C10H10ClFO/c1-6-2-3-13-10-8(6)4-7(11)5-9(10)12/h4-6H,2-3H2,1H3
InChIKeyAMBVDCIYJVMEJU-UHFFFAOYSA-N
MW200.64 g/mol
LogP3.37
Rot. Bonds

About 6-chloro-8-fluoro-4-methyl-3,4-dihydro-2H-chromene

6-chloro-8-fluoro-4-methyl-3,4-dihydro-2H-chromene (PubChem CID 175804511) has the molecular formula C10H10ClFO and a molecular weight of 200.64 g/mol. Its IUPAC name is 6-chloro-8-fluoro-4-methyl-3,4-dihydro-2H-chromene.

Molecular Properties

Compound Name6-chloro-8-fluoro-4-methyl-3,4-dihydro-2H-chromene
PubChem CID175804511
Molecular FormulaC10H10ClFO
Molecular Weight200.64 g/mol
Exact Mass200.04
IUPAC Name6-chloro-8-fluoro-4-methyl-3,4-dihydro-2H-chromene
SMILESCC1CCOc2c(F)cc(Cl)cc21
InChIInChI=1S/C10H10ClFO/c1-6-2-3-13-10-8(6)4-7(11)5-9(10)12/h4-6H,2-3H2,1H3
InChIKeyAMBVDCIYJVMEJU-UHFFFAOYSA-N
XLogP3.37
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.64
LogP ≤ 53.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

6-Chloro-2-(4-chlorophenyl)-3,4-dihydro-2H-1-benzopyran
CID 126331
1-(2-Bromoethoxy)-4-chloro-2-methylbenzene
CID 24707923
3-[(4-chlorophenyl)methyl]-3,4-dihydro-2H-chromene
CID 45268104
(3Z)-6-chloro-3-[(4-chlorophenyl)methylidene]-4H-chromene
CID 45268974
6-chloro-3-[(4-chlorophenyl)methyl]-3,4-dihydro-2H-chromene
CID 45268978
6-chloro-3-[(4-chlorophenyl)methyl]-2H-chromene
CID 45272388
6-chloro-3-[(E)-3-phenylprop-1-enyl]-2H-chromene
CID 56655958
6-chloro-3-[3-(3-chlorophenyl)propyl]-3,4-dihydro-2H-chromene
CID 137640366
3-[3-(3-chlorophenyl)propyl]-3,4-dihydro-2H-chromene
CID 137654412
6-chloro-2-phenyl-2H-chromene
CID 11402251
3-benzyl-6-chloro-3,4-dihydro-2H-chromene
CID 45269837
(3Z)-3-benzylidene-6-chloro-4H-chromene
CID 45270658

Frequently Asked Questions

What is the IUPAC name of 6-chloro-8-fluoro-4-methyl-3,4-dihydro-2H-chromene?
The IUPAC name of 6-chloro-8-fluoro-4-methyl-3,4-dihydro-2H-chromene (CID 175804511) is 6-chloro-8-fluoro-4-methyl-3,4-dihydro-2H-chromene.
What is the SMILES notation for 6-chloro-8-fluoro-4-methyl-3,4-dihydro-2H-chromene?
The canonical SMILES for 6-chloro-8-fluoro-4-methyl-3,4-dihydro-2H-chromene is CC1CCOc2c(F)cc(Cl)cc21.
What is the InChIKey of 6-chloro-8-fluoro-4-methyl-3,4-dihydro-2H-chromene?
The InChIKey is AMBVDCIYJVMEJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10ClFO/c1-6-2-3-13-10-8(6)4-7(11)5-9(10)12/h4-6H,2-3H2,1H3.
What are the key properties of 6-chloro-8-fluoro-4-methyl-3,4-dihydro-2H-chromene?
6-chloro-8-fluoro-4-methyl-3,4-dihydro-2H-chromene has a molecular weight of 200.64 g/mol, XLogP of 3.37, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-8-fluoro-4-methyl-3,4-dihydro-2H-chromene is sourced from PubChem (CID 175804511), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).