(6-chloro-2-iodo-3-methoxyphenyl)methanol

C8H8ClIO2 — CID 171002946

IUPAC(6-chloro-2-iodo-3-methoxyphenyl)methanol
SMILESCOc1ccc(Cl)c(CO)c1I
InChIInChI=1S/C8H8ClIO2/c1-12-7-3-2-6(9)5(4-11)8(7)10/h2-3,11H,4H2,1H3
InChIKeySYZGNUFBASRFQJ-UHFFFAOYSA-N
MW298.51 g/mol
LogP2.45
Rot. Bonds2

About (6-chloro-2-iodo-3-methoxyphenyl)methanol

(6-chloro-2-iodo-3-methoxyphenyl)methanol (PubChem CID 171002946) has the molecular formula C8H8ClIO2 and a molecular weight of 298.51 g/mol. Its IUPAC name is (6-chloro-2-iodo-3-methoxyphenyl)methanol.

Molecular Properties

Compound Name(6-chloro-2-iodo-3-methoxyphenyl)methanol
PubChem CID171002946
Molecular FormulaC8H8ClIO2
Molecular Weight298.51 g/mol
Exact Mass297.93
IUPAC Name(6-chloro-2-iodo-3-methoxyphenyl)methanol
SMILESCOc1ccc(Cl)c(CO)c1I
InChIInChI=1S/C8H8ClIO2/c1-12-7-3-2-6(9)5(4-11)8(7)10/h2-3,11H,4H2,1H3
InChIKeySYZGNUFBASRFQJ-UHFFFAOYSA-N
XLogP2.45
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.51
LogP ≤ 52.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze (6-chloro-2-iodo-3-methoxyphenyl)methanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(2,3-dichloro-6-methoxyphenyl)methanol
CID 130133361
1-chloro-3-iodo-4-methoxy-2-methylbenzene
CID 91025767
2,3-diiodo-1,4-dimethoxybenzene
CID 11653980
1-chloro-2-ethyl-4-methoxy-3-methylbenzene
CID 118491478
[4-[3-chloro-2-(hydroxymethyl)phenoxy]-3-methoxyphenyl]methanol
CID 107743505
1-chloro-2-ethyl-3-fluoro-4-methoxybenzene
CID 118261733
[2-chloro-6-(2-methoxyphenyl)sulfanylphenyl]methanol
CID 63835528
3-(6-chloro-2,3-dimethoxyphenyl)propan-1-amine
CID 117331594
[6-chloro-2-methoxy-3-(trifluoromethyl)phenyl]methanol
CID 171003011
1-(6-chloro-2,3-dimethoxyphenyl)propan-2-ol
CID 117333392
[2-chloro-6-(2-methoxy-5-nitrophenoxy)phenyl]methanol
CID 61031935
(2,3-dibromo-6-methoxyphenyl)methanol
CID 171002454

Frequently Asked Questions

What is the IUPAC name of (6-chloro-2-iodo-3-methoxyphenyl)methanol?
The IUPAC name of (6-chloro-2-iodo-3-methoxyphenyl)methanol (CID 171002946) is (6-chloro-2-iodo-3-methoxyphenyl)methanol.
What is the SMILES notation for (6-chloro-2-iodo-3-methoxyphenyl)methanol?
The canonical SMILES for (6-chloro-2-iodo-3-methoxyphenyl)methanol is COc1ccc(Cl)c(CO)c1I.
What is the InChIKey of (6-chloro-2-iodo-3-methoxyphenyl)methanol?
The InChIKey is SYZGNUFBASRFQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8ClIO2/c1-12-7-3-2-6(9)5(4-11)8(7)10/h2-3,11H,4H2,1H3.
What are the key properties of (6-chloro-2-iodo-3-methoxyphenyl)methanol?
(6-chloro-2-iodo-3-methoxyphenyl)methanol has a molecular weight of 298.51 g/mol, XLogP of 2.45, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (6-chloro-2-iodo-3-methoxyphenyl)methanol is sourced from PubChem (CID 171002946), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).