(3,4-dichlorophenyl)-(3-methoxyphenyl)methanol

C14H12Cl2O2 — CID 61083356

IUPAC(3,4-dichlorophenyl)-(3-methoxyphenyl)methanol
SMILESCOc1cccc(C(O)c2ccc(Cl)c(Cl)c2)c1
InChIInChI=1S/C14H12Cl2O2/c1-18-11-4-2-3-9(7-11)14(17)10-5-6-12(15)13(16)8-10/h2-8,14,17H,1H3
InChIKeyAYKGSOPHMLZUSO-UHFFFAOYSA-N
MW283.15 g/mol
LogP4.08
Rot. Bonds3

About (3,4-dichlorophenyl)-(3-methoxyphenyl)methanol

(3,4-dichlorophenyl)-(3-methoxyphenyl)methanol (PubChem CID 61083356) has the molecular formula C14H12Cl2O2 and a molecular weight of 283.15 g/mol. Its IUPAC name is (3,4-dichlorophenyl)-(3-methoxyphenyl)methanol.

Molecular Properties

Compound Name(3,4-dichlorophenyl)-(3-methoxyphenyl)methanol
PubChem CID61083356
Molecular FormulaC14H12Cl2O2
Molecular Weight283.15 g/mol
Exact Mass282.02
IUPAC Name(3,4-dichlorophenyl)-(3-methoxyphenyl)methanol
SMILESCOc1cccc(C(O)c2ccc(Cl)c(Cl)c2)c1
InChIInChI=1S/C14H12Cl2O2/c1-18-11-4-2-3-9(7-11)14(17)10-5-6-12(15)13(16)8-10/h2-8,14,17H,1H3
InChIKeyAYKGSOPHMLZUSO-UHFFFAOYSA-N
XLogP4.08
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.15
LogP ≤ 54.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(R)-(4-chlorophenyl)-(3-methoxyphenyl)methanol
CID 7146657
(S)-(4-chlorophenyl)-(3-methoxyphenyl)methanol
CID 7146658
(3-chloro-4,5-dimethoxyphenyl)-(3-methoxyphenyl)methanol
CID 60955788
(3,4-dichlorophenyl)-(3-methoxy-4-methylphenyl)methanol
CID 61081399
(R)-(3,4-dichlorophenyl)-phenylmethanol
CID 7153278
[4-(dimethylamino)phenyl]-(3-methoxyphenyl)methanol
CID 63893480
(R)-(3,4-dichlorophenyl)-(3-fluorophenyl)methanol
CID 7153378
(4-chloro-3-methoxyphenyl)-(3,5-dimethoxyphenyl)methanol
CID 79697124
(3-methoxyphenyl)-(4-propylphenyl)methanol
CID 61087387
(4-ethylsulfanylphenyl)-(3-methoxyphenyl)methanol
CID 106848346
3,4-dichloro-N-[1-(3-methoxyphenyl)ethyl]aniline
CID 43108106
(1R)-1-(3-methoxyphenyl)ethanol
CID 10219539

Frequently Asked Questions

What is the IUPAC name of (3,4-dichlorophenyl)-(3-methoxyphenyl)methanol?
The IUPAC name of (3,4-dichlorophenyl)-(3-methoxyphenyl)methanol (CID 61083356) is (3,4-dichlorophenyl)-(3-methoxyphenyl)methanol.
What is the SMILES notation for (3,4-dichlorophenyl)-(3-methoxyphenyl)methanol?
The canonical SMILES for (3,4-dichlorophenyl)-(3-methoxyphenyl)methanol is COc1cccc(C(O)c2ccc(Cl)c(Cl)c2)c1.
What is the InChIKey of (3,4-dichlorophenyl)-(3-methoxyphenyl)methanol?
The InChIKey is AYKGSOPHMLZUSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12Cl2O2/c1-18-11-4-2-3-9(7-11)14(17)10-5-6-12(15)13(16)8-10/h2-8,14,17H,1H3.
What are the key properties of (3,4-dichlorophenyl)-(3-methoxyphenyl)methanol?
(3,4-dichlorophenyl)-(3-methoxyphenyl)methanol has a molecular weight of 283.15 g/mol, XLogP of 4.08, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3,4-dichlorophenyl)-(3-methoxyphenyl)methanol is sourced from PubChem (CID 61083356), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).