(7-chloro-1-benzofuran-2-yl)-(2-methoxyphenyl)methanol

C16H13ClO3 — CID 114723264

IUPAC(7-chloro-1-benzofuran-2-yl)-(2-methoxyphenyl)methanol
SMILESCOc1ccccc1C(O)c1cc2cccc(Cl)c2o1
InChIInChI=1S/C16H13ClO3/c1-19-13-8-3-2-6-11(13)15(18)14-9-10-5-4-7-12(17)16(10)20-14/h2-9,15,18H,1H3
InChIKeyYBXHFIXEWPSADR-UHFFFAOYSA-N
MW288.73 g/mol
LogP4.18
Rot. Bonds3

About (7-chloro-1-benzofuran-2-yl)-(2-methoxyphenyl)methanol

(7-chloro-1-benzofuran-2-yl)-(2-methoxyphenyl)methanol (PubChem CID 114723264) has the molecular formula C16H13ClO3 and a molecular weight of 288.73 g/mol. Its IUPAC name is (7-chloro-1-benzofuran-2-yl)-(2-methoxyphenyl)methanol.

Molecular Properties

Compound Name(7-chloro-1-benzofuran-2-yl)-(2-methoxyphenyl)methanol
PubChem CID114723264
Molecular FormulaC16H13ClO3
Molecular Weight288.73 g/mol
Exact Mass288.06
IUPAC Name(7-chloro-1-benzofuran-2-yl)-(2-methoxyphenyl)methanol
SMILESCOc1ccccc1C(O)c1cc2cccc(Cl)c2o1
InChIInChI=1S/C16H13ClO3/c1-19-13-8-3-2-6-11(13)15(18)14-9-10-5-4-7-12(17)16(10)20-14/h2-9,15,18H,1H3
InChIKeyYBXHFIXEWPSADR-UHFFFAOYSA-N
XLogP4.18
TPSA42.60 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.73
LogP ≤ 54.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(7-chloro-1-benzofuran-2-yl)-(5-chloro-2-methoxyphenyl)methanol
CID 115837576
(5-bromo-2-methoxyphenyl)-(7-chloro-1-benzofuran-2-yl)methanol
CID 114723276
(7-chloro-1-benzofuran-2-yl)-(2-chloro-3-fluorophenyl)methanol
CID 115837553
1-benzofuran-2-yl-(2-fluoro-3-methoxyphenyl)methanol
CID 82805523
(4-bromophenyl)-(7-chloro-1-benzofuran-2-yl)methanol
CID 114723321
(2,3-dichlorophenyl)-(7-methyl-1-benzofuran-2-yl)methanol
CID 114723415
(2-bromo-5-fluorophenyl)-(7-chloro-1-benzofuran-2-yl)methanol
CID 115837557
(2-ethoxyphenyl)-(7-methyl-1-benzofuran-2-yl)methanol
CID 114723269
(7-chloro-1-benzofuran-2-yl)-(2-fluoro-4-methylphenyl)methanol
CID 115837454
(7-bromo-1-benzofuran-2-yl)-(5-fluoro-2-methoxyphenyl)methanol
CID 105122296
1-benzothiophen-3-yl-(7-chloro-1-benzofuran-2-yl)methanol
CID 114723580
1-(7-chloro-1-benzofuran-2-yl)-2-methylpropan-1-ol
CID 65426322

Frequently Asked Questions

What is the IUPAC name of (7-chloro-1-benzofuran-2-yl)-(2-methoxyphenyl)methanol?
The IUPAC name of (7-chloro-1-benzofuran-2-yl)-(2-methoxyphenyl)methanol (CID 114723264) is (7-chloro-1-benzofuran-2-yl)-(2-methoxyphenyl)methanol.
What is the SMILES notation for (7-chloro-1-benzofuran-2-yl)-(2-methoxyphenyl)methanol?
The canonical SMILES for (7-chloro-1-benzofuran-2-yl)-(2-methoxyphenyl)methanol is COc1ccccc1C(O)c1cc2cccc(Cl)c2o1.
What is the InChIKey of (7-chloro-1-benzofuran-2-yl)-(2-methoxyphenyl)methanol?
The InChIKey is YBXHFIXEWPSADR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13ClO3/c1-19-13-8-3-2-6-11(13)15(18)14-9-10-5-4-7-12(17)16(10)20-14/h2-9,15,18H,1H3.
What are the key properties of (7-chloro-1-benzofuran-2-yl)-(2-methoxyphenyl)methanol?
(7-chloro-1-benzofuran-2-yl)-(2-methoxyphenyl)methanol has a molecular weight of 288.73 g/mol, XLogP of 4.18, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (7-chloro-1-benzofuran-2-yl)-(2-methoxyphenyl)methanol is sourced from PubChem (CID 114723264), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).