2-(3-chloro-4-propylphenyl)ethanol

C11H15ClO — CID 105425048

IUPAC2-(3-chloro-4-propylphenyl)ethanol
SMILESCCCc1ccc(CCO)cc1Cl
InChIInChI=1S/C11H15ClO/c1-2-3-10-5-4-9(6-7-13)8-11(10)12/h4-5,8,13H,2-3,6-7H2,1H3
InChIKeyRWVPEWFMGMPQMJ-UHFFFAOYSA-N
MW198.69 g/mol
LogP2.83
Rot. Bonds4

About 2-(3-chloro-4-propylphenyl)ethanol

2-(3-chloro-4-propylphenyl)ethanol (PubChem CID 105425048) has the molecular formula C11H15ClO and a molecular weight of 198.69 g/mol. Its IUPAC name is 2-(3-chloro-4-propylphenyl)ethanol.

Molecular Properties

Compound Name2-(3-chloro-4-propylphenyl)ethanol
PubChem CID105425048
Molecular FormulaC11H15ClO
Molecular Weight198.69 g/mol
Exact Mass198.08
IUPAC Name2-(3-chloro-4-propylphenyl)ethanol
SMILESCCCc1ccc(CCO)cc1Cl
InChIInChI=1S/C11H15ClO/c1-2-3-10-5-4-9(6-7-13)8-11(10)12/h4-5,8,13H,2-3,6-7H2,1H3
InChIKeyRWVPEWFMGMPQMJ-UHFFFAOYSA-N
XLogP2.83
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.69
LogP ≤ 52.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(4-butyl-2-chlorophenyl)methanol
CID 22508825
2-(4-amino-3-chlorophenyl)ethanol
CID 54268347
2-(3-chloro-4-propylphenyl)-2,2-difluoroethanol
CID 105425063
3-[2-chloro-4-(fluoromethyl)phenyl]propan-1-ol
CID 117291231
2-[3-ethyl-4-[2-ethyl-4-[2-(4-propylphenyl)ethyl]phenyl]phenyl]ethanol
CID 118150619
2-chloro-4-propylaniline
CID 19914844
2-[4-(2-fluoro-4-propylphenyl)phenyl]ethanol
CID 134432733
2-(2-chloro-4-methoxyphenyl)ethanol
CID 66697098
2-chloro-4-ethylsulfonyl-1-propylbenzene
CID 59864430
(4-chloro-2-propylphenyl)methanol
CID 165125586
N-[[2-chloro-4-(3-propylphenyl)phenyl]methyl]ethanamine
CID 116545338
N-[(2-chloro-4-ethylphenyl)methyl]-3-hydroxypropanamide
CID 142183582

Frequently Asked Questions

What is the IUPAC name of 2-(3-chloro-4-propylphenyl)ethanol?
The IUPAC name of 2-(3-chloro-4-propylphenyl)ethanol (CID 105425048) is 2-(3-chloro-4-propylphenyl)ethanol.
What is the SMILES notation for 2-(3-chloro-4-propylphenyl)ethanol?
The canonical SMILES for 2-(3-chloro-4-propylphenyl)ethanol is CCCc1ccc(CCO)cc1Cl.
What is the InChIKey of 2-(3-chloro-4-propylphenyl)ethanol?
The InChIKey is RWVPEWFMGMPQMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15ClO/c1-2-3-10-5-4-9(6-7-13)8-11(10)12/h4-5,8,13H,2-3,6-7H2,1H3.
What are the key properties of 2-(3-chloro-4-propylphenyl)ethanol?
2-(3-chloro-4-propylphenyl)ethanol has a molecular weight of 198.69 g/mol, XLogP of 2.83, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-chloro-4-propylphenyl)ethanol is sourced from PubChem (CID 105425048), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).