(2-chloro-4-fluorophenyl)-cyclopropylmethanol

C10H10ClFO — CID 58392404

IUPAC(2-chloro-4-fluorophenyl)-cyclopropylmethanol
SMILESOC(c1ccc(F)cc1Cl)C1CC1
InChIInChI=1S/C10H10ClFO/c11-9-5-7(12)3-4-8(9)10(13)6-1-2-6/h3-6,10,13H,1-2H2
InChIKeyDUGZKFVLBXOCST-UHFFFAOYSA-N
MW200.64 g/mol
LogP2.92
Rot. Bonds2

About (2-chloro-4-fluorophenyl)-cyclopropylmethanol

(2-chloro-4-fluorophenyl)-cyclopropylmethanol (PubChem CID 58392404) has the molecular formula C10H10ClFO and a molecular weight of 200.64 g/mol. Its IUPAC name is (2-chloro-4-fluorophenyl)-cyclopropylmethanol.

Molecular Properties

Compound Name(2-chloro-4-fluorophenyl)-cyclopropylmethanol
PubChem CID58392404
Molecular FormulaC10H10ClFO
Molecular Weight200.64 g/mol
Exact Mass200.04
IUPAC Name(2-chloro-4-fluorophenyl)-cyclopropylmethanol
SMILESOC(c1ccc(F)cc1Cl)C1CC1
InChIInChI=1S/C10H10ClFO/c11-9-5-7(12)3-4-8(9)10(13)6-1-2-6/h3-6,10,13H,1-2H2
InChIKeyDUGZKFVLBXOCST-UHFFFAOYSA-N
XLogP2.92
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.64
LogP ≤ 52.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(1R,2S)-2-amino-2-(2-chloro-4-fluorophenyl)-1-cyclopropylethanol
CID 171161359
(2-chloro-4-fluorophenyl)-(oxan-3-yl)methanol
CID 107136089
(2-chloro-4-methylphenyl)-cyclopropylmethanol
CID 58392529
(2-chloro-4-fluorophenyl)-(2-ethylcyclohexyl)methanol
CID 63861648
(5-bromo-2-chlorophenyl)-cyclopropylmethanol
CID 115810196
cyclobutyl-(4-fluoro-2-methylphenyl)methanol
CID 64987002
cyclopentyl-(4-fluoro-2-methylphenyl)methanol
CID 62789449
(2,4-difluorophenyl)-(oxan-4-yl)methanol
CID 62905509
(2-bromo-4-fluorophenyl)-cyclohexylmethanol
CID 91636325
(R)-(2-chlorophenyl)-cyclopentylmethanol
CID 93462160
cycloheptyl-(2,5-difluorophenyl)methanol
CID 55091243
(R)-cycloheptyl-(2,5-difluorophenyl)methanol
CID 94502433

Frequently Asked Questions

What is the IUPAC name of (2-chloro-4-fluorophenyl)-cyclopropylmethanol?
The IUPAC name of (2-chloro-4-fluorophenyl)-cyclopropylmethanol (CID 58392404) is (2-chloro-4-fluorophenyl)-cyclopropylmethanol.
What is the SMILES notation for (2-chloro-4-fluorophenyl)-cyclopropylmethanol?
The canonical SMILES for (2-chloro-4-fluorophenyl)-cyclopropylmethanol is OC(c1ccc(F)cc1Cl)C1CC1.
What is the InChIKey of (2-chloro-4-fluorophenyl)-cyclopropylmethanol?
The InChIKey is DUGZKFVLBXOCST-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10ClFO/c11-9-5-7(12)3-4-8(9)10(13)6-1-2-6/h3-6,10,13H,1-2H2.
What are the key properties of (2-chloro-4-fluorophenyl)-cyclopropylmethanol?
(2-chloro-4-fluorophenyl)-cyclopropylmethanol has a molecular weight of 200.64 g/mol, XLogP of 2.92, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2-chloro-4-fluorophenyl)-cyclopropylmethanol is sourced from PubChem (CID 58392404), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).