3-[5-(2,4-dichlorophenyl)furan-2-yl]propan-1-ol

C13H12Cl2O2 — CID 170887541

IUPAC3-[5-(2,4-dichlorophenyl)furan-2-yl]propan-1-ol
SMILESOCCCc1ccc(-c2ccc(Cl)cc2Cl)o1
InChIInChI=1S/C13H12Cl2O2/c14-9-3-5-11(12(15)8-9)13-6-4-10(17-13)2-1-7-16/h3-6,8,16H,1-2,7H2
InChIKeyAPPNEFIEBSPNOI-UHFFFAOYSA-N
MW271.14 g/mol
LogP4.18
Rot. Bonds4

About 3-[5-(2,4-dichlorophenyl)furan-2-yl]propan-1-ol

3-[5-(2,4-dichlorophenyl)furan-2-yl]propan-1-ol (PubChem CID 170887541) has the molecular formula C13H12Cl2O2 and a molecular weight of 271.14 g/mol. Its IUPAC name is 3-[5-(2,4-dichlorophenyl)furan-2-yl]propan-1-ol.

Molecular Properties

Compound Name3-[5-(2,4-dichlorophenyl)furan-2-yl]propan-1-ol
PubChem CID170887541
Molecular FormulaC13H12Cl2O2
Molecular Weight271.14 g/mol
Exact Mass270.02
IUPAC Name3-[5-(2,4-dichlorophenyl)furan-2-yl]propan-1-ol
SMILESOCCCc1ccc(-c2ccc(Cl)cc2Cl)o1
InChIInChI=1S/C13H12Cl2O2/c14-9-3-5-11(12(15)8-9)13-6-4-10(17-13)2-1-7-16/h3-6,8,16H,1-2,7H2
InChIKeyAPPNEFIEBSPNOI-UHFFFAOYSA-N
XLogP4.18
TPSA33.37 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.14
LogP ≤ 54.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-[5-(4-chlorophenyl)furan-2-yl]propan-1-ol
CID 170887546
3-[5-(2,4-dichlorophenyl)furan-2-yl]propanehydrazide
CID 91686857
1-(4-chlorophenyl)-N-[[5-(2,4-dichlorophenyl)furan-2-yl]methyl]methanamine
CID 71611033
5-[[5-(2,5-dichlorophenyl)furan-2-yl]methylamino]pentan-1-ol
CID 17211736
1-[5-(2,4-dichlorophenyl)furan-2-yl]-N-propylpropan-2-amine
CID 63398553
3-[5-(2-chlorophenyl)furan-2-yl]propan-1-amine
CID 170878490
N-[3-chloro-4-[5-(hydroxymethyl)furan-2-yl]phenyl]-5-(2,4-dichlorophenyl)furan-2-carboxamide
CID 28669866
N-[[5-(2,4-dichlorophenyl)furan-2-yl]methyl]octan-1-amine;hydrochloride
CID 17332919
N-[[5-(2,4-dichlorophenyl)furan-2-yl]methyl]-4-fluoroaniline
CID 1446213
(2-chlorophenyl)methyl-[[5-(2,4-dichlorophenyl)furan-2-yl]methyl]azanium
CID 8636558
N-[[5-(2,4-dichlorophenyl)furan-2-yl]methylidene]hydroxylamine
CID 73164714
2-[[5-(2,4-dichlorophenyl)furan-2-yl]methylazaniumyl]ethyl-dimethylazanium
CID 7425234

Frequently Asked Questions

What is the IUPAC name of 3-[5-(2,4-dichlorophenyl)furan-2-yl]propan-1-ol?
The IUPAC name of 3-[5-(2,4-dichlorophenyl)furan-2-yl]propan-1-ol (CID 170887541) is 3-[5-(2,4-dichlorophenyl)furan-2-yl]propan-1-ol.
What is the SMILES notation for 3-[5-(2,4-dichlorophenyl)furan-2-yl]propan-1-ol?
The canonical SMILES for 3-[5-(2,4-dichlorophenyl)furan-2-yl]propan-1-ol is OCCCc1ccc(-c2ccc(Cl)cc2Cl)o1.
What is the InChIKey of 3-[5-(2,4-dichlorophenyl)furan-2-yl]propan-1-ol?
The InChIKey is APPNEFIEBSPNOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12Cl2O2/c14-9-3-5-11(12(15)8-9)13-6-4-10(17-13)2-1-7-16/h3-6,8,16H,1-2,7H2.
What are the key properties of 3-[5-(2,4-dichlorophenyl)furan-2-yl]propan-1-ol?
3-[5-(2,4-dichlorophenyl)furan-2-yl]propan-1-ol has a molecular weight of 271.14 g/mol, XLogP of 4.18, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[5-(2,4-dichlorophenyl)furan-2-yl]propan-1-ol is sourced from PubChem (CID 170887541), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).