(4-chloro-3-methylphenyl)-(furan-3-yl)methanol

C12H11ClO2 — CID 91636310

IUPAC(4-chloro-3-methylphenyl)-(furan-3-yl)methanol
SMILESCc1cc(C(O)c2ccoc2)ccc1Cl
InChIInChI=1S/C12H11ClO2/c1-8-6-9(2-3-11(8)13)12(14)10-4-5-15-7-10/h2-7,12,14H,1H3
InChIKeyKMFCSWMJHUUMDH-UHFFFAOYSA-N
MW222.67 g/mol
LogP3.32
Rot. Bonds2

About (4-chloro-3-methylphenyl)-(furan-3-yl)methanol

(4-chloro-3-methylphenyl)-(furan-3-yl)methanol (PubChem CID 91636310) has the molecular formula C12H11ClO2 and a molecular weight of 222.67 g/mol. Its IUPAC name is (4-chloro-3-methylphenyl)-(furan-3-yl)methanol.

Molecular Properties

Compound Name(4-chloro-3-methylphenyl)-(furan-3-yl)methanol
PubChem CID91636310
Molecular FormulaC12H11ClO2
Molecular Weight222.67 g/mol
Exact Mass222.04
IUPAC Name(4-chloro-3-methylphenyl)-(furan-3-yl)methanol
SMILESCc1cc(C(O)c2ccoc2)ccc1Cl
InChIInChI=1S/C12H11ClO2/c1-8-6-9(2-3-11(8)13)12(14)10-4-5-15-7-10/h2-7,12,14H,1H3
InChIKeyKMFCSWMJHUUMDH-UHFFFAOYSA-N
XLogP3.32
TPSA33.37 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.67
LogP ≤ 53.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(S)-(4-fluoro-3-methylphenyl)-(furan-3-yl)methanol
CID 95252370
(3-bromo-4-chlorophenyl)-(furan-3-yl)methanol
CID 115566408
(R)-(3-chloro-4-fluorophenyl)-(furan-3-yl)methanol
CID 95256733
(4-chloro-3-methylphenyl)-(3,4-difluorophenyl)methanol
CID 113397251
(4-chloro-3-methylphenyl)-(3-fluoro-4-methylphenyl)methanol
CID 107130625
(4-chloro-3-methylphenyl)-pyrimidin-5-ylmethanol
CID 115781666
(4-chloro-3-methylphenyl)-(5-methylthiophen-3-yl)methanol
CID 115807784
(2,5-dichlorothiophen-3-yl)-(furan-3-yl)methanol
CID 61081034
(4-chloro-3-methylphenyl)-(4-cyclobutylphenyl)methanol
CID 115836307
(3-bromo-5-chlorophenyl)-(furan-3-yl)methanol
CID 107947484
N-[1-(4-chloro-3-methylphenyl)-2-(furan-3-yl)ethyl]propan-1-amine
CID 105029948
(S)-(3,5-difluorophenyl)-(furan-3-yl)methanol
CID 95363998

Frequently Asked Questions

What is the IUPAC name of (4-chloro-3-methylphenyl)-(furan-3-yl)methanol?
The IUPAC name of (4-chloro-3-methylphenyl)-(furan-3-yl)methanol (CID 91636310) is (4-chloro-3-methylphenyl)-(furan-3-yl)methanol.
What is the SMILES notation for (4-chloro-3-methylphenyl)-(furan-3-yl)methanol?
The canonical SMILES for (4-chloro-3-methylphenyl)-(furan-3-yl)methanol is Cc1cc(C(O)c2ccoc2)ccc1Cl.
What is the InChIKey of (4-chloro-3-methylphenyl)-(furan-3-yl)methanol?
The InChIKey is KMFCSWMJHUUMDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11ClO2/c1-8-6-9(2-3-11(8)13)12(14)10-4-5-15-7-10/h2-7,12,14H,1H3.
What are the key properties of (4-chloro-3-methylphenyl)-(furan-3-yl)methanol?
(4-chloro-3-methylphenyl)-(furan-3-yl)methanol has a molecular weight of 222.67 g/mol, XLogP of 3.32, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4-chloro-3-methylphenyl)-(furan-3-yl)methanol is sourced from PubChem (CID 91636310), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).