(2R)-1-(2,5-dichlorophenoxy)propan-2-ol

C9H10Cl2O2 — CID 106933028

IUPAC(2R)-1-(2,5-dichlorophenoxy)propan-2-ol
SMILESC[C@@H](O)COc1cc(Cl)ccc1Cl
InChIInChI=1S/C9H10Cl2O2/c1-6(12)5-13-9-4-7(10)2-3-8(9)11/h2-4,6,12H,5H2,1H3/t6-/m1/s1
InChIKeySVODAVRVLXGJTH-ZCFIWIBFSA-N
MW221.08 g/mol
LogP2.75
Rot. Bonds3

About (2R)-1-(2,5-dichlorophenoxy)propan-2-ol

(2R)-1-(2,5-dichlorophenoxy)propan-2-ol (PubChem CID 106933028) has the molecular formula C9H10Cl2O2 and a molecular weight of 221.08 g/mol. Its IUPAC name is (2R)-1-(2,5-dichlorophenoxy)propan-2-ol.

Molecular Properties

Compound Name(2R)-1-(2,5-dichlorophenoxy)propan-2-ol
PubChem CID106933028
Molecular FormulaC9H10Cl2O2
Molecular Weight221.08 g/mol
Exact Mass220.01
IUPAC Name(2R)-1-(2,5-dichlorophenoxy)propan-2-ol
SMILESC[C@@H](O)COc1cc(Cl)ccc1Cl
InChIInChI=1S/C9H10Cl2O2/c1-6(12)5-13-9-4-7(10)2-3-8(9)11/h2-4,6,12H,5H2,1H3/t6-/m1/s1
InChIKeySVODAVRVLXGJTH-ZCFIWIBFSA-N
XLogP2.75
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.08
LogP ≤ 52.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(5-chloro-2-methylphenoxy)propan-2-ol
CID 21423645
[(2S)-3-(2,5-dichlorophenoxy)-2-hydroxypropyl]azanium
CID 9159109
4-(2,5-dichlorophenoxy)-3-methylbutanoic acid
CID 82091057
2-(2,5-dichlorophenoxy)-N-(2-hydroxypropyl)acetamide
CID 43394146
methyl 2-amino-3-(2,5-dichlorophenoxy)propanoate
CID 116820903
1-(2,5-dichlorophenoxy)-3-[1-(dimethylamino)propan-2-ylamino]propan-2-ol
CID 82939369
[(1R)-1-(3-chlorophenyl)ethyl]-[(2R)-3-(2,5-dichlorophenoxy)-2-hydroxypropyl]azanium
CID 2520203
1-(2,5-dichlorophenoxy)-3-(3-methylpentan-3-ylamino)propan-2-ol
CID 103746646
(2R)-1-(4-chloro-2-nitrophenoxy)propan-2-ol
CID 106933009
[3-(2,5-dichlorophenoxy)-2-hydroxypropyl]-methylsulfamic acid
CID 2832246
(2S)-1-(4-bromo-2-chlorophenoxy)propan-2-ol
CID 106933022
1-(2-chloro-4-fluorophenoxy)propan-2-ol
CID 65277724

Frequently Asked Questions

What is the IUPAC name of (2R)-1-(2,5-dichlorophenoxy)propan-2-ol?
The IUPAC name of (2R)-1-(2,5-dichlorophenoxy)propan-2-ol (CID 106933028) is (2R)-1-(2,5-dichlorophenoxy)propan-2-ol.
What is the SMILES notation for (2R)-1-(2,5-dichlorophenoxy)propan-2-ol?
The canonical SMILES for (2R)-1-(2,5-dichlorophenoxy)propan-2-ol is C[C@@H](O)COc1cc(Cl)ccc1Cl.
What is the InChIKey of (2R)-1-(2,5-dichlorophenoxy)propan-2-ol?
The InChIKey is SVODAVRVLXGJTH-ZCFIWIBFSA-N. The full InChI is InChI=1S/C9H10Cl2O2/c1-6(12)5-13-9-4-7(10)2-3-8(9)11/h2-4,6,12H,5H2,1H3/t6-/m1/s1.
What are the key properties of (2R)-1-(2,5-dichlorophenoxy)propan-2-ol?
(2R)-1-(2,5-dichlorophenoxy)propan-2-ol has a molecular weight of 221.08 g/mol, XLogP of 2.75, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-1-(2,5-dichlorophenoxy)propan-2-ol is sourced from PubChem (CID 106933028), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).