(3,4-dichlorophenyl)-(3-methoxy-4-methylphenyl)methanol

C15H14Cl2O2 — CID 61081399

IUPAC(3,4-dichlorophenyl)-(3-methoxy-4-methylphenyl)methanol
SMILESCOc1cc(C(O)c2ccc(Cl)c(Cl)c2)ccc1C
InChIInChI=1S/C15H14Cl2O2/c1-9-3-4-11(8-14(9)19-2)15(18)10-5-6-12(16)13(17)7-10/h3-8,15,18H,1-2H3
InChIKeyCIJHHORMJDIDSF-UHFFFAOYSA-N
MW297.18 g/mol
LogP4.39
Rot. Bonds3

About (3,4-dichlorophenyl)-(3-methoxy-4-methylphenyl)methanol

(3,4-dichlorophenyl)-(3-methoxy-4-methylphenyl)methanol (PubChem CID 61081399) has the molecular formula C15H14Cl2O2 and a molecular weight of 297.18 g/mol. Its IUPAC name is (3,4-dichlorophenyl)-(3-methoxy-4-methylphenyl)methanol.

Molecular Properties

Compound Name(3,4-dichlorophenyl)-(3-methoxy-4-methylphenyl)methanol
PubChem CID61081399
Molecular FormulaC15H14Cl2O2
Molecular Weight297.18 g/mol
Exact Mass296.04
IUPAC Name(3,4-dichlorophenyl)-(3-methoxy-4-methylphenyl)methanol
SMILESCOc1cc(C(O)c2ccc(Cl)c(Cl)c2)ccc1C
InChIInChI=1S/C15H14Cl2O2/c1-9-3-4-11(8-14(9)19-2)15(18)10-5-6-12(16)13(17)7-10/h3-8,15,18H,1-2H3
InChIKeyCIJHHORMJDIDSF-UHFFFAOYSA-N
XLogP4.39
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.18
LogP ≤ 54.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(3,4-dichlorophenyl)-(4-fluoro-3-methoxyphenyl)methanol
CID 81284055
(3,4-dichlorophenyl)-(3-methoxyphenyl)methanol
CID 61083356
(3,4-diethylphenyl)-(3-methoxy-4-methylphenyl)methanol
CID 115482617
(3-methoxy-4-methylphenyl)-thiophen-3-ylmethanol
CID 115805659
(3-fluoro-5-methylphenyl)-(3-methoxy-4-methylphenyl)methanol
CID 115823139
(4-chloro-3-methoxyphenyl)-(3,5-dimethoxyphenyl)methanol
CID 79697124
(4-chloro-3-methoxyphenyl)-(3-chloro-5-methylphenyl)methanol
CID 115818074
(2-bromo-4,5-dimethoxyphenyl)-(3,4-dichlorophenyl)methanol
CID 61087950
(R)-(3,4-dichlorophenyl)-phenylmethanol
CID 7153278
1-(4-chloro-3-methoxyphenyl)-1-(3-methoxy-4-methylphenyl)-N-methylmethanamine
CID 105006926
(4-chloro-2-methoxyphenyl)-(3-chloro-4-methylphenyl)methanol
CID 107560197
(3-bromo-4-fluorophenyl)-(4-chloro-3-methoxyphenyl)methanol
CID 79697409

Frequently Asked Questions

What is the IUPAC name of (3,4-dichlorophenyl)-(3-methoxy-4-methylphenyl)methanol?
The IUPAC name of (3,4-dichlorophenyl)-(3-methoxy-4-methylphenyl)methanol (CID 61081399) is (3,4-dichlorophenyl)-(3-methoxy-4-methylphenyl)methanol.
What is the SMILES notation for (3,4-dichlorophenyl)-(3-methoxy-4-methylphenyl)methanol?
The canonical SMILES for (3,4-dichlorophenyl)-(3-methoxy-4-methylphenyl)methanol is COc1cc(C(O)c2ccc(Cl)c(Cl)c2)ccc1C.
What is the InChIKey of (3,4-dichlorophenyl)-(3-methoxy-4-methylphenyl)methanol?
The InChIKey is CIJHHORMJDIDSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14Cl2O2/c1-9-3-4-11(8-14(9)19-2)15(18)10-5-6-12(16)13(17)7-10/h3-8,15,18H,1-2H3.
What are the key properties of (3,4-dichlorophenyl)-(3-methoxy-4-methylphenyl)methanol?
(3,4-dichlorophenyl)-(3-methoxy-4-methylphenyl)methanol has a molecular weight of 297.18 g/mol, XLogP of 4.39, 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-methoxy-4-methylphenyl)methanol is sourced from PubChem (CID 61081399), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).