(3-chlorophenyl)-fluoromethanol

C7H6ClFO — CID 70239224

IUPAC(3-chlorophenyl)-fluoromethanol
SMILESOC(F)c1cccc(Cl)c1
InChIInChI=1S/C7H6ClFO/c8-6-3-1-2-5(4-6)7(9)10/h1-4,7,10H
InChIKeyAOGRGYDRTLPUHT-UHFFFAOYSA-N
MW160.57 g/mol
LogP2.30
Rot. Bonds1

About (3-chlorophenyl)-fluoromethanol

(3-chlorophenyl)-fluoromethanol (PubChem CID 70239224) has the molecular formula C7H6ClFO and a molecular weight of 160.57 g/mol. Its IUPAC name is (3-chlorophenyl)-fluoromethanol.

Molecular Properties

Compound Name(3-chlorophenyl)-fluoromethanol
PubChem CID70239224
Molecular FormulaC7H6ClFO
Molecular Weight160.57 g/mol
Exact Mass160.01
IUPAC Name(3-chlorophenyl)-fluoromethanol
SMILESOC(F)c1cccc(Cl)c1
InChIInChI=1S/C7H6ClFO/c8-6-3-1-2-5(4-6)7(9)10/h1-4,7,10H
InChIKeyAOGRGYDRTLPUHT-UHFFFAOYSA-N
XLogP2.30
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500160.57
LogP ≤ 52.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(3-chlorophenyl)methanediol
CID 20679602
(1R)-1-(3-chlorophenyl)-2-methylpropan-1-ol
CID 93312224
[(3-chlorophenyl)-hydroxymethyl]phosphonic acid
CID 24866948
3-(3-chlorophenyl)butan-2-ol
CID 66437186
(1R)-2-chloro-1-(3-chlorophenyl)ethanol
CID 10375278
(3-chlorophenyl)-(3,5-difluorophenyl)methanol
CID 2757448
(2R)-2-amino-2-(4-chloro-2-fluorophenyl)-1-(3-chlorophenyl)ethanol
CID 89490664
(2S)-2-amino-1-(3-chlorophenyl)-2-(4-chlorophenyl)ethanol
CID 118633773
(2R)-2-amino-1-(3-chlorophenyl)-2-(4-chlorophenyl)ethanol
CID 89490826
(1S)-2-amino-1-(3-chlorophenyl)-2-(4-chlorophenyl)ethanol
CID 118631975
(2S,3S)-3-amino-3-(3-chlorophenyl)-2-hydroxypropanoic acid
CID 2762309
(S)-(3-chloro-5-fluorophenyl)-(3-chlorophenyl)methanol
CID 7153369

Frequently Asked Questions

What is the IUPAC name of (3-chlorophenyl)-fluoromethanol?
The IUPAC name of (3-chlorophenyl)-fluoromethanol (CID 70239224) is (3-chlorophenyl)-fluoromethanol.
What is the SMILES notation for (3-chlorophenyl)-fluoromethanol?
The canonical SMILES for (3-chlorophenyl)-fluoromethanol is OC(F)c1cccc(Cl)c1.
What is the InChIKey of (3-chlorophenyl)-fluoromethanol?
The InChIKey is AOGRGYDRTLPUHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6ClFO/c8-6-3-1-2-5(4-6)7(9)10/h1-4,7,10H.
What are the key properties of (3-chlorophenyl)-fluoromethanol?
(3-chlorophenyl)-fluoromethanol has a molecular weight of 160.57 g/mol, XLogP of 2.30, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3-chlorophenyl)-fluoromethanol is sourced from PubChem (CID 70239224), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).