(4-chloro-2-iodo-6-methylphenyl)methanol

C8H8ClIO — CID 146445151

IUPAC(4-chloro-2-iodo-6-methylphenyl)methanol
SMILESCc1cc(Cl)cc(I)c1CO
InChIInChI=1S/C8H8ClIO/c1-5-2-6(9)3-8(10)7(5)4-11/h2-3,11H,4H2,1H3
InChIKeyVCRNAMJEEYPIHC-UHFFFAOYSA-N
MW282.51 g/mol
LogP2.75
Rot. Bonds1

About (4-chloro-2-iodo-6-methylphenyl)methanol

(4-chloro-2-iodo-6-methylphenyl)methanol (PubChem CID 146445151) has the molecular formula C8H8ClIO and a molecular weight of 282.51 g/mol. Its IUPAC name is (4-chloro-2-iodo-6-methylphenyl)methanol.

Molecular Properties

Compound Name(4-chloro-2-iodo-6-methylphenyl)methanol
PubChem CID146445151
Molecular FormulaC8H8ClIO
Molecular Weight282.51 g/mol
Exact Mass281.93
IUPAC Name(4-chloro-2-iodo-6-methylphenyl)methanol
SMILESCc1cc(Cl)cc(I)c1CO
InChIInChI=1S/C8H8ClIO/c1-5-2-6(9)3-8(10)7(5)4-11/h2-3,11H,4H2,1H3
InChIKeyVCRNAMJEEYPIHC-UHFFFAOYSA-N
XLogP2.75
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.51
LogP ≤ 52.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'iodine', 'substructure': 'N/A'}

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Related Compounds

2-(4-chloro-2-iodo-6-methylphenyl)acetic acid
CID 86229802
ethane;(2,4,6-trimethylphenyl)methanol
CID 143599991
(4-chloro-5-iodo-2-methylphenyl)methanol
CID 118380437
(5-chloro-4-iodo-2-methylphenyl)methanol
CID 171004062
2-(3-bromopropoxy)-5-chloro-1-iodo-3-methylbenzene
CID 58516586
(6-iodo-4-methyl-1-benzothiophen-7-yl)methanol
CID 131122786
[4-(3-chloro-4-fluorophenyl)-2,6-dimethylphenyl]methanol
CID 172876857
1-(2,4-dichloro-6-methylphenyl)-N-methylmethanamine
CID 18721638
2,4-bis(hydroxymethyl)-3,5-dimethylphenol
CID 71367739
[2-(2,5-dichlorophenoxy)-4,6-dimethyl-3-pyridinyl]methanol
CID 61257315
5-chloro-3-iodo-2-methylbenzoic acid
CID 82883475
1-(5-chloro-2-iodo-3-methylphenyl)ethanone
CID 171003749

Frequently Asked Questions

What is the IUPAC name of (4-chloro-2-iodo-6-methylphenyl)methanol?
The IUPAC name of (4-chloro-2-iodo-6-methylphenyl)methanol (CID 146445151) is (4-chloro-2-iodo-6-methylphenyl)methanol.
What is the SMILES notation for (4-chloro-2-iodo-6-methylphenyl)methanol?
The canonical SMILES for (4-chloro-2-iodo-6-methylphenyl)methanol is Cc1cc(Cl)cc(I)c1CO.
What is the InChIKey of (4-chloro-2-iodo-6-methylphenyl)methanol?
The InChIKey is VCRNAMJEEYPIHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8ClIO/c1-5-2-6(9)3-8(10)7(5)4-11/h2-3,11H,4H2,1H3.
What are the key properties of (4-chloro-2-iodo-6-methylphenyl)methanol?
(4-chloro-2-iodo-6-methylphenyl)methanol has a molecular weight of 282.51 g/mol, XLogP of 2.75, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (4-chloro-2-iodo-6-methylphenyl)methanol is sourced from PubChem (CID 146445151), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).