3,4-dihydro-2H-chromen-8-yl-(2-methylphenyl)methanol

C17H18O2 — CID 114743328

IUPAC3,4-dihydro-2H-chromen-8-yl-(2-methylphenyl)methanol
SMILESCc1ccccc1C(O)c1cccc2c1OCCC2
InChIInChI=1S/C17H18O2/c1-12-6-2-3-9-14(12)16(18)15-10-4-7-13-8-5-11-19-17(13)15/h2-4,6-7,9-10,16,18H,5,8,11H2,1H3
InChIKeyZSVZHOIEAPNWOB-UHFFFAOYSA-N
MW254.33 g/mol
LogP3.40
Rot. Bonds2

About 3,4-dihydro-2H-chromen-8-yl-(2-methylphenyl)methanol

3,4-dihydro-2H-chromen-8-yl-(2-methylphenyl)methanol (PubChem CID 114743328) has the molecular formula C17H18O2 and a molecular weight of 254.33 g/mol. Its IUPAC name is 3,4-dihydro-2H-chromen-8-yl-(2-methylphenyl)methanol.

Molecular Properties

Compound Name3,4-dihydro-2H-chromen-8-yl-(2-methylphenyl)methanol
PubChem CID114743328
Molecular FormulaC17H18O2
Molecular Weight254.33 g/mol
Exact Mass254.13
IUPAC Name3,4-dihydro-2H-chromen-8-yl-(2-methylphenyl)methanol
SMILESCc1ccccc1C(O)c1cccc2c1OCCC2
InChIInChI=1S/C17H18O2/c1-12-6-2-3-9-14(12)16(18)15-10-4-7-13-8-5-11-19-17(13)15/h2-4,6-7,9-10,16,18H,5,8,11H2,1H3
InChIKeyZSVZHOIEAPNWOB-UHFFFAOYSA-N
XLogP3.40
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.33
LogP ≤ 53.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3,4-dihydro-2H-chromen-8-yl-(2-fluorophenyl)methanol
CID 114743309
3,4-dihydro-2H-chromen-8-yl-(2-iodophenyl)methanol
CID 115837843
(4-bromo-3,5-dimethylphenyl)-(3,4-dihydro-2H-chromen-8-yl)methanol
CID 114744817
(2-chlorofuran-3-yl)-(3,4-dihydro-2H-chromen-8-yl)methanol
CID 106694050
2,3-dihydro-1-benzofuran-7-yl-(2,5-dimethylphenyl)methanol
CID 114743334
1-(3,4-dihydro-2H-chromen-8-yl)butane-1,2-diol
CID 103454473
(3-chloro-2-fluorophenyl)-(3,4-dihydro-2H-chromen-8-yl)methanol
CID 114743779
(3-bromo-2-chlorophenyl)-(3,4-dihydro-2H-chromen-8-yl)methanol
CID 115837822
3,4-dihydro-2H-chromen-8-yl-(3-methoxy-4-methylphenyl)methanol
CID 115837852
3,4-dihydro-2H-chromen-8-yl-(4-ethylphenyl)methanol
CID 114743317
3,4-dihydro-2H-chromen-8-yl-[4-(dimethylamino)phenyl]methanol
CID 114743263
2,3-dihydro-1-benzofuran-7-yl-(3-methyl-4-pyridinyl)methanol
CID 114744728

Frequently Asked Questions

What is the IUPAC name of 3,4-dihydro-2H-chromen-8-yl-(2-methylphenyl)methanol?
The IUPAC name of 3,4-dihydro-2H-chromen-8-yl-(2-methylphenyl)methanol (CID 114743328) is 3,4-dihydro-2H-chromen-8-yl-(2-methylphenyl)methanol.
What is the SMILES notation for 3,4-dihydro-2H-chromen-8-yl-(2-methylphenyl)methanol?
The canonical SMILES for 3,4-dihydro-2H-chromen-8-yl-(2-methylphenyl)methanol is Cc1ccccc1C(O)c1cccc2c1OCCC2.
What is the InChIKey of 3,4-dihydro-2H-chromen-8-yl-(2-methylphenyl)methanol?
The InChIKey is ZSVZHOIEAPNWOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18O2/c1-12-6-2-3-9-14(12)16(18)15-10-4-7-13-8-5-11-19-17(13)15/h2-4,6-7,9-10,16,18H,5,8,11H2,1H3.
What are the key properties of 3,4-dihydro-2H-chromen-8-yl-(2-methylphenyl)methanol?
3,4-dihydro-2H-chromen-8-yl-(2-methylphenyl)methanol has a molecular weight of 254.33 g/mol, XLogP of 3.40, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4-dihydro-2H-chromen-8-yl-(2-methylphenyl)methanol is sourced from PubChem (CID 114743328), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).