2-(2,5-dichloro-4-methoxyphenyl)propan-2-ol

C10H12Cl2O2 — CID 84698274

IUPAC2-(2,5-dichloro-4-methoxyphenyl)propan-2-ol
SMILESCOc1cc(Cl)c(C(C)(C)O)cc1Cl
InChIInChI=1S/C10H12Cl2O2/c1-10(2,13)6-4-8(12)9(14-3)5-7(6)11/h4-5,13H,1-3H3
InChIKeyDDCIJYUMRKRYPI-UHFFFAOYSA-N
MW235.11 g/mol
LogP3.23
Rot. Bonds2

About 2-(2,5-dichloro-4-methoxyphenyl)propan-2-ol

2-(2,5-dichloro-4-methoxyphenyl)propan-2-ol (PubChem CID 84698274) has the molecular formula C10H12Cl2O2 and a molecular weight of 235.11 g/mol. Its IUPAC name is 2-(2,5-dichloro-4-methoxyphenyl)propan-2-ol.

Molecular Properties

Compound Name2-(2,5-dichloro-4-methoxyphenyl)propan-2-ol
PubChem CID84698274
Molecular FormulaC10H12Cl2O2
Molecular Weight235.11 g/mol
Exact Mass234.02
IUPAC Name2-(2,5-dichloro-4-methoxyphenyl)propan-2-ol
SMILESCOc1cc(Cl)c(C(C)(C)O)cc1Cl
InChIInChI=1S/C10H12Cl2O2/c1-10(2,13)6-4-8(12)9(14-3)5-7(6)11/h4-5,13H,1-3H3
InChIKeyDDCIJYUMRKRYPI-UHFFFAOYSA-N
XLogP3.23
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.11
LogP ≤ 53.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2-chloro-4,5-dimethoxyphenyl)propan-2-ol
CID 84694057
2-(2,5-dichloro-4-methoxyphenyl)-2-methylpropan-1-ol
CID 82296791
2-(2-chloro-4-methoxy-5-propan-2-yloxyphenyl)propan-2-ol
CID 117400657
2-tert-butyl-5-chloro-4-methoxyphenol
CID 134599266
2-[2,5-bis(2-hydroxypropan-2-yl)-4-methoxyphenyl]propan-2-ol
CID 59095315
2-(5-chloro-4-methoxy-2-propan-2-ylphenyl)-2-methylpropan-1-ol
CID 117395472
2-(3-chloro-2-fluoro-4,5-dimethoxyphenyl)propan-2-ol
CID 84706691
1-chloro-2-methoxy-4-methyl-5-(trifluoromethyl)benzene
CID 116964823
3-(5-chloro-2-ethoxy-4-methoxyphenyl)-3-methylbutanoic acid
CID 117462479
2-[2-chloro-6-methoxy-4-(trifluoromethyl)phenyl]propan-2-ol
CID 117425049
2-(2-amino-4,5-dichlorophenyl)propan-2-ol
CID 139377730
2-(4,5-difluoro-2-methoxyphenyl)propan-2-ol
CID 84670502

Frequently Asked Questions

What is the IUPAC name of 2-(2,5-dichloro-4-methoxyphenyl)propan-2-ol?
The IUPAC name of 2-(2,5-dichloro-4-methoxyphenyl)propan-2-ol (CID 84698274) is 2-(2,5-dichloro-4-methoxyphenyl)propan-2-ol.
What is the SMILES notation for 2-(2,5-dichloro-4-methoxyphenyl)propan-2-ol?
The canonical SMILES for 2-(2,5-dichloro-4-methoxyphenyl)propan-2-ol is COc1cc(Cl)c(C(C)(C)O)cc1Cl.
What is the InChIKey of 2-(2,5-dichloro-4-methoxyphenyl)propan-2-ol?
The InChIKey is DDCIJYUMRKRYPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12Cl2O2/c1-10(2,13)6-4-8(12)9(14-3)5-7(6)11/h4-5,13H,1-3H3.
What are the key properties of 2-(2,5-dichloro-4-methoxyphenyl)propan-2-ol?
2-(2,5-dichloro-4-methoxyphenyl)propan-2-ol has a molecular weight of 235.11 g/mol, XLogP of 3.23, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,5-dichloro-4-methoxyphenyl)propan-2-ol is sourced from PubChem (CID 84698274), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).