1-(2,5-dichlorophenyl)-2-methoxypropan-1-ol

C10H12Cl2O2 — CID 79615936

IUPAC1-(2,5-dichlorophenyl)-2-methoxypropan-1-ol
SMILESCOC(C)C(O)c1cc(Cl)ccc1Cl
InChIInChI=1S/C10H12Cl2O2/c1-6(14-2)10(13)8-5-7(11)3-4-9(8)12/h3-6,10,13H,1-2H3
InChIKeyIDQAQLBGHATCJJ-UHFFFAOYSA-N
MW235.11 g/mol
LogP3.06
Rot. Bonds3

About 1-(2,5-dichlorophenyl)-2-methoxypropan-1-ol

1-(2,5-dichlorophenyl)-2-methoxypropan-1-ol (PubChem CID 79615936) has the molecular formula C10H12Cl2O2 and a molecular weight of 235.11 g/mol. Its IUPAC name is 1-(2,5-dichlorophenyl)-2-methoxypropan-1-ol.

Molecular Properties

Compound Name1-(2,5-dichlorophenyl)-2-methoxypropan-1-ol
PubChem CID79615936
Molecular FormulaC10H12Cl2O2
Molecular Weight235.11 g/mol
Exact Mass234.02
IUPAC Name1-(2,5-dichlorophenyl)-2-methoxypropan-1-ol
SMILESCOC(C)C(O)c1cc(Cl)ccc1Cl
InChIInChI=1S/C10H12Cl2O2/c1-6(14-2)10(13)8-5-7(11)3-4-9(8)12/h3-6,10,13H,1-2H3
InChIKeyIDQAQLBGHATCJJ-UHFFFAOYSA-N
XLogP3.06
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.11
LogP ≤ 53.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2,2-dichloro-1-(2,5-dichlorophenyl)ethanol
CID 70495317
1-(2,5-dichlorophenyl)-2-methoxy-3-methylbutan-1-amine
CID 116719639
1-(2,5-dichlorophenyl)-2-(1-methoxypropan-2-ylamino)ethanol
CID 60897086
2-methoxy-1-(2,3,4-trifluorophenyl)propan-1-ol
CID 79616894
1-(5-bromo-2-fluorophenyl)-2-methoxypropan-1-ol
CID 79743530
1-(5-chloro-2-methoxyphenyl)-2,3-dimethylbutan-1-ol
CID 104546198
(2,5-dichlorophenyl)-(2-methoxyphenyl)methanol
CID 61082800
1-(2,5-dichlorophenyl)-3-methoxy-3-methylbutan-1-ol
CID 103027501
2-(2,5-dichlorophenyl)propanoyl chloride
CID 117047606
amino-[(1R,2R)-1-(2,5-dichlorophenyl)-1-(methoxymethoxy)propan-2-yl]oxymethanol
CID 163943329
[(2R)-1-(2,4-dichlorophenyl)-1-hydroxypropan-2-yl] carbamate
CID 145362480
(2,5-dichlorophenyl)-(1-methoxycyclopentyl)methanol
CID 104610351

Frequently Asked Questions

What is the IUPAC name of 1-(2,5-dichlorophenyl)-2-methoxypropan-1-ol?
The IUPAC name of 1-(2,5-dichlorophenyl)-2-methoxypropan-1-ol (CID 79615936) is 1-(2,5-dichlorophenyl)-2-methoxypropan-1-ol.
What is the SMILES notation for 1-(2,5-dichlorophenyl)-2-methoxypropan-1-ol?
The canonical SMILES for 1-(2,5-dichlorophenyl)-2-methoxypropan-1-ol is COC(C)C(O)c1cc(Cl)ccc1Cl.
What is the InChIKey of 1-(2,5-dichlorophenyl)-2-methoxypropan-1-ol?
The InChIKey is IDQAQLBGHATCJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12Cl2O2/c1-6(14-2)10(13)8-5-7(11)3-4-9(8)12/h3-6,10,13H,1-2H3.
What are the key properties of 1-(2,5-dichlorophenyl)-2-methoxypropan-1-ol?
1-(2,5-dichlorophenyl)-2-methoxypropan-1-ol has a molecular weight of 235.11 g/mol, XLogP of 3.06, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,5-dichlorophenyl)-2-methoxypropan-1-ol is sourced from PubChem (CID 79615936), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).