[1-(3,4-dichlorophenyl)imidazol-4-yl]methanol

C10H8Cl2N2O — CID 23444980

IUPAC[1-(3,4-dichlorophenyl)imidazol-4-yl]methanol
SMILESOCc1cn(-c2ccc(Cl)c(Cl)c2)cn1
InChIInChI=1S/C10H8Cl2N2O/c11-9-2-1-8(3-10(9)12)14-4-7(5-15)13-6-14/h1-4,6,15H,5H2
InChIKeyOACLLBLDCGRRAK-UHFFFAOYSA-N
MW243.09 g/mol
LogP2.67
Rot. Bonds2

About [1-(3,4-dichlorophenyl)imidazol-4-yl]methanol

[1-(3,4-dichlorophenyl)imidazol-4-yl]methanol (PubChem CID 23444980) has the molecular formula C10H8Cl2N2O and a molecular weight of 243.09 g/mol. Its IUPAC name is [1-(3,4-dichlorophenyl)imidazol-4-yl]methanol.

Molecular Properties

Compound Name[1-(3,4-dichlorophenyl)imidazol-4-yl]methanol
PubChem CID23444980
Molecular FormulaC10H8Cl2N2O
Molecular Weight243.09 g/mol
Exact Mass242.00
IUPAC Name[1-(3,4-dichlorophenyl)imidazol-4-yl]methanol
SMILESOCc1cn(-c2ccc(Cl)c(Cl)c2)cn1
InChIInChI=1S/C10H8Cl2N2O/c11-9-2-1-8(3-10(9)12)14-4-7(5-15)13-6-14/h1-4,6,15H,5H2
InChIKeyOACLLBLDCGRRAK-UHFFFAOYSA-N
XLogP2.67
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.09
LogP ≤ 52.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-butyl-1-(3,4-dichlorophenyl)imidazole
CID 91436989
[1-(4-fluoro-3-methylphenyl)imidazol-4-yl]methanol
CID 23445149
[1-[4-(aminomethyl)phenyl]imidazol-4-yl]methanol
CID 174723685
[1-(1,3-dihydro-2-benzofuran-5-yl)imidazol-4-yl]methanol
CID 23445211
[1-(3-chloro-4-methylphenyl)imidazol-4-yl]methanamine
CID 82472948
1-[[1-(3,4-dichlorophenyl)imidazol-4-yl]methyl]-2,5-dimethylimidazole
CID 141054833
[1-(4-methylsulfanylphenyl)imidazol-4-yl]methanol
CID 23445034
5-[4-(hydroxymethyl)imidazol-1-yl]-2-methylbenzonitrile
CID 175229447
[1-(5-bromo-3-pyridinyl)imidazol-4-yl]methanol
CID 130487124
4-(4-bromoimidazol-1-yl)-2-chloroaniline
CID 155581370
6-[4-[4-(hydroxymethyl)imidazol-1-yl]phenyl]-2-methylpyridazin-3-one
CID 68510946
2-[1-(4-chlorophenyl)imidazol-4-yl]acetic acid
CID 82476530

Frequently Asked Questions

What is the IUPAC name of [1-(3,4-dichlorophenyl)imidazol-4-yl]methanol?
The IUPAC name of [1-(3,4-dichlorophenyl)imidazol-4-yl]methanol (CID 23444980) is [1-(3,4-dichlorophenyl)imidazol-4-yl]methanol.
What is the SMILES notation for [1-(3,4-dichlorophenyl)imidazol-4-yl]methanol?
The canonical SMILES for [1-(3,4-dichlorophenyl)imidazol-4-yl]methanol is OCc1cn(-c2ccc(Cl)c(Cl)c2)cn1.
What is the InChIKey of [1-(3,4-dichlorophenyl)imidazol-4-yl]methanol?
The InChIKey is OACLLBLDCGRRAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8Cl2N2O/c11-9-2-1-8(3-10(9)12)14-4-7(5-15)13-6-14/h1-4,6,15H,5H2.
What are the key properties of [1-(3,4-dichlorophenyl)imidazol-4-yl]methanol?
[1-(3,4-dichlorophenyl)imidazol-4-yl]methanol has a molecular weight of 243.09 g/mol, XLogP of 2.67, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(3,4-dichlorophenyl)imidazol-4-yl]methanol is sourced from PubChem (CID 23444980), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).