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

C14H13ClO3 — CID 106694050

IUPAC(2-chlorofuran-3-yl)-(3,4-dihydro-2H-chromen-8-yl)methanol
SMILESOC(c1ccoc1Cl)c1cccc2c1OCCC2
InChIInChI=1S/C14H13ClO3/c15-14-11(6-8-18-14)12(16)10-5-1-3-9-4-2-7-17-13(9)10/h1,3,5-6,8,12,16H,2,4,7H2
InChIKeyDPSJQIYCRULQEW-UHFFFAOYSA-N
MW264.71 g/mol
LogP3.34
Rot. Bonds2

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

(2-chlorofuran-3-yl)-(3,4-dihydro-2H-chromen-8-yl)methanol (PubChem CID 106694050) has the molecular formula C14H13ClO3 and a molecular weight of 264.71 g/mol. Its IUPAC name is (2-chlorofuran-3-yl)-(3,4-dihydro-2H-chromen-8-yl)methanol.

Molecular Properties

Compound Name(2-chlorofuran-3-yl)-(3,4-dihydro-2H-chromen-8-yl)methanol
PubChem CID106694050
Molecular FormulaC14H13ClO3
Molecular Weight264.71 g/mol
Exact Mass264.06
IUPAC Name(2-chlorofuran-3-yl)-(3,4-dihydro-2H-chromen-8-yl)methanol
SMILESOC(c1ccoc1Cl)c1cccc2c1OCCC2
InChIInChI=1S/C14H13ClO3/c15-14-11(6-8-18-14)12(16)10-5-1-3-9-4-2-7-17-13(9)10/h1,3,5-6,8,12,16H,2,4,7H2
InChIKeyDPSJQIYCRULQEW-UHFFFAOYSA-N
XLogP3.34
TPSA42.60 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.71
LogP ≤ 53.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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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-methylphenyl)methanol
CID 114743328
3,4-dihydro-2H-chromen-8-yl-(2-iodophenyl)methanol
CID 115837843
(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
(2-amino-4-chlorophenyl)-(3,4-dihydro-2H-chromen-8-yl)methanol
CID 114744548
(2-chlorophenyl)-(2,3-dihydro-1-benzofuran-7-yl)methanol
CID 114743289
(3-bromo-5-chlorophenyl)-(3,4-dihydro-2H-chromen-8-yl)methanol
CID 107947846
(2-bromo-3,4-difluorophenyl)-(3,4-dihydro-2H-chromen-8-yl)methanol
CID 107538517
3,4-dihydro-2H-chromen-8-yl(pyrazolo[1,5-a]pyridin-3-yl)methanol
CID 103129264
2,3-dihydro-1-benzofuran-7-yl-(2-iodophenyl)methanol
CID 115838946
1-(3,4-dihydro-2H-chromen-8-yl)butane-1,2-diol
CID 103454473

Frequently Asked Questions

What is the IUPAC name of (2-chlorofuran-3-yl)-(3,4-dihydro-2H-chromen-8-yl)methanol?
The IUPAC name of (2-chlorofuran-3-yl)-(3,4-dihydro-2H-chromen-8-yl)methanol (CID 106694050) is (2-chlorofuran-3-yl)-(3,4-dihydro-2H-chromen-8-yl)methanol.
What is the SMILES notation for (2-chlorofuran-3-yl)-(3,4-dihydro-2H-chromen-8-yl)methanol?
The canonical SMILES for (2-chlorofuran-3-yl)-(3,4-dihydro-2H-chromen-8-yl)methanol is OC(c1ccoc1Cl)c1cccc2c1OCCC2.
What is the InChIKey of (2-chlorofuran-3-yl)-(3,4-dihydro-2H-chromen-8-yl)methanol?
The InChIKey is DPSJQIYCRULQEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13ClO3/c15-14-11(6-8-18-14)12(16)10-5-1-3-9-4-2-7-17-13(9)10/h1,3,5-6,8,12,16H,2,4,7H2.
What are the key properties of (2-chlorofuran-3-yl)-(3,4-dihydro-2H-chromen-8-yl)methanol?
(2-chlorofuran-3-yl)-(3,4-dihydro-2H-chromen-8-yl)methanol has a molecular weight of 264.71 g/mol, XLogP of 3.34, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2-chlorofuran-3-yl)-(3,4-dihydro-2H-chromen-8-yl)methanol is sourced from PubChem (CID 106694050), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).