5,7-difluoro-4-methyl-2,3-dihydrochromen-4-ol

C10H10F2O2 — CID 58392170

IUPAC5,7-difluoro-4-methyl-2,3-dihydrochromen-4-ol
SMILESCC1(O)CCOc2cc(F)cc(F)c21
InChIInChI=1S/C10H10F2O2/c1-10(13)2-3-14-8-5-6(11)4-7(12)9(8)10/h4-5,13H,2-3H2,1H3
InChIKeyBLRYJPGPQRFVIN-UHFFFAOYSA-N
MW200.18 g/mol
LogP1.95
Rot. Bonds

About 5,7-difluoro-4-methyl-2,3-dihydrochromen-4-ol

5,7-difluoro-4-methyl-2,3-dihydrochromen-4-ol (PubChem CID 58392170) has the molecular formula C10H10F2O2 and a molecular weight of 200.18 g/mol. Its IUPAC name is 5,7-difluoro-4-methyl-2,3-dihydrochromen-4-ol.

Molecular Properties

Compound Name5,7-difluoro-4-methyl-2,3-dihydrochromen-4-ol
PubChem CID58392170
Molecular FormulaC10H10F2O2
Molecular Weight200.18 g/mol
Exact Mass200.06
IUPAC Name5,7-difluoro-4-methyl-2,3-dihydrochromen-4-ol
SMILESCC1(O)CCOc2cc(F)cc(F)c21
InChIInChI=1S/C10H10F2O2/c1-10(13)2-3-14-8-5-6(11)4-7(12)9(8)10/h4-5,13H,2-3H2,1H3
InChIKeyBLRYJPGPQRFVIN-UHFFFAOYSA-N
XLogP1.95
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.18
LogP ≤ 51.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 72861
Benzenemethanol, 2-(phenylmethoxy)-
CID 18811
Chroman-4-ol
CID 92890
3,4-Dihydro-6-methoxy-2,2-dimethyl-2H-1-benzopyran-4-ol
CID 24252761
Benzenemethanol, 2-ethoxy-
CID 51381
2-Phenoxybenzyl alcohol
CID 3660111
6-Hydroxy-2,2-dimethylchroman
CID 150948
3,4-Dihydro-6-methyl-2H-1-benzopyran-4-ol
CID 12328973
Chroman
CID 136319
8-Fluoro-2-methyl-2-(4-methylpentyl)-3,4-dihydrochromen-6-ol
CID 73051099
9-Phenylxanthen-9-ol
CID 68997
(4S)-3,4-dihydro-2H-1-benzopyran-4-ol
CID 7058027

Frequently Asked Questions

What is the IUPAC name of 5,7-difluoro-4-methyl-2,3-dihydrochromen-4-ol?
The IUPAC name of 5,7-difluoro-4-methyl-2,3-dihydrochromen-4-ol (CID 58392170) is 5,7-difluoro-4-methyl-2,3-dihydrochromen-4-ol.
What is the SMILES notation for 5,7-difluoro-4-methyl-2,3-dihydrochromen-4-ol?
The canonical SMILES for 5,7-difluoro-4-methyl-2,3-dihydrochromen-4-ol is CC1(O)CCOc2cc(F)cc(F)c21.
What is the InChIKey of 5,7-difluoro-4-methyl-2,3-dihydrochromen-4-ol?
The InChIKey is BLRYJPGPQRFVIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10F2O2/c1-10(13)2-3-14-8-5-6(11)4-7(12)9(8)10/h4-5,13H,2-3H2,1H3.
What are the key properties of 5,7-difluoro-4-methyl-2,3-dihydrochromen-4-ol?
5,7-difluoro-4-methyl-2,3-dihydrochromen-4-ol has a molecular weight of 200.18 g/mol, XLogP of 1.95, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5,7-difluoro-4-methyl-2,3-dihydrochromen-4-ol is sourced from PubChem (CID 58392170), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).