(5-chloro-2-methoxyphenyl)-(furan-3-yl)methanol

C12H11ClO3 — CID 63894957

IUPAC(5-chloro-2-methoxyphenyl)-(furan-3-yl)methanol
SMILESCOc1ccc(Cl)cc1C(O)c1ccoc1
InChIInChI=1S/C12H11ClO3/c1-15-11-3-2-9(13)6-10(11)12(14)8-4-5-16-7-8/h2-7,12,14H,1H3
InChIKeySZGDUUOHVGGISP-UHFFFAOYSA-N
MW238.67 g/mol
LogP3.02
Rot. Bonds3

About (5-chloro-2-methoxyphenyl)-(furan-3-yl)methanol

(5-chloro-2-methoxyphenyl)-(furan-3-yl)methanol (PubChem CID 63894957) has the molecular formula C12H11ClO3 and a molecular weight of 238.67 g/mol. Its IUPAC name is (5-chloro-2-methoxyphenyl)-(furan-3-yl)methanol.

Molecular Properties

Compound Name(5-chloro-2-methoxyphenyl)-(furan-3-yl)methanol
PubChem CID63894957
Molecular FormulaC12H11ClO3
Molecular Weight238.67 g/mol
Exact Mass238.04
IUPAC Name(5-chloro-2-methoxyphenyl)-(furan-3-yl)methanol
SMILESCOc1ccc(Cl)cc1C(O)c1ccoc1
InChIInChI=1S/C12H11ClO3/c1-15-11-3-2-9(13)6-10(11)12(14)8-4-5-16-7-8/h2-7,12,14H,1H3
InChIKeySZGDUUOHVGGISP-UHFFFAOYSA-N
XLogP3.02
TPSA42.60 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.67
LogP ≤ 53.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(5-chloro-2-methoxyphenyl)-[4-(difluoromethyl)phenyl]methanol
CID 115525000
(4-aminophenyl)-(5-chloro-2-methoxyphenyl)methanol
CID 106695594
(4-chloro-3-fluorophenyl)-(5-chloro-2-methoxyphenyl)methanol
CID 63895530
(5-chloro-2-methoxyphenyl)-[4-(trifluoromethyl)phenyl]methanol
CID 63896012
furan-3-yl-(3,4,5-trimethoxyphenyl)methanol
CID 63948143
(5-chloro-2-methoxyphenyl)-(2,4,5-trifluorophenyl)methanol
CID 103303352
(5-chloro-2-fluorophenyl)-(5-fluoro-2-methoxyphenyl)methanol
CID 61087442
(4-chlorophenyl)-(2,4,5-trimethoxyphenyl)methanol
CID 61101584
5-chloro-N-[2-(furan-3-yl)-2-hydroxyethyl]-2-methoxybenzenesulfonamide
CID 71798368
(5-chloro-2-methoxyphenyl)-[3-(difluoromethoxy)phenyl]methanol
CID 104546174
(5-chloro-2-methoxyphenyl)-(3-propylphenyl)methanol
CID 115838131
(5-chloro-2-fluorophenyl)-(4-methoxy-3-methylphenyl)methanol
CID 61081454

Frequently Asked Questions

What is the IUPAC name of (5-chloro-2-methoxyphenyl)-(furan-3-yl)methanol?
The IUPAC name of (5-chloro-2-methoxyphenyl)-(furan-3-yl)methanol (CID 63894957) is (5-chloro-2-methoxyphenyl)-(furan-3-yl)methanol.
What is the SMILES notation for (5-chloro-2-methoxyphenyl)-(furan-3-yl)methanol?
The canonical SMILES for (5-chloro-2-methoxyphenyl)-(furan-3-yl)methanol is COc1ccc(Cl)cc1C(O)c1ccoc1.
What is the InChIKey of (5-chloro-2-methoxyphenyl)-(furan-3-yl)methanol?
The InChIKey is SZGDUUOHVGGISP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11ClO3/c1-15-11-3-2-9(13)6-10(11)12(14)8-4-5-16-7-8/h2-7,12,14H,1H3.
What are the key properties of (5-chloro-2-methoxyphenyl)-(furan-3-yl)methanol?
(5-chloro-2-methoxyphenyl)-(furan-3-yl)methanol has a molecular weight of 238.67 g/mol, XLogP of 3.02, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5-chloro-2-methoxyphenyl)-(furan-3-yl)methanol is sourced from PubChem (CID 63894957), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).