chempirical

(R)-1-(4-Fluorophenyl)ethanol

C8H9FOCAS 101219-68-5140.16 g/mol

Open in Covalent MOL file
FHO
AlcoholAryl halide

Properties

Molecular formula
C8H9FO
Molar mass
140.16 g/mol
Exact mass
140.0637 Da
logP
1.88Crippen estimate
Polar surface area
20.2 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
1
Stereocentres
Rin SMILES atom order

Hazards

Warning
Irritant (GHS07)

Aggregated from 40 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number
101219-68-5
SMILES
C[C@H](C1=CC=C(C=C1)F)O
InChIKey
PSDSORRYQPTKSV-ZCFIWIBFSA-N
InChI
InChI=1S/C8H9FO/c1-6(10)7-2-4-8(9)5-3-7/h2-6,10H,1H3/t6-/m1/s1

Weigh it out

Type any one amount. The others follow from the molar mass.

Work with (R)-1-(4-Fluorophenyl)ethanol

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

1-(4-Hydroxyphenyl)ethanol2380-91-858 % similar 1-(4-Methylphenyl)ethanol536-50-558 % similar 1-Phenylethanol13323-81-456 % similar (S)-1-Phenylethanol1445-91-656 % similar (+)-1-Phenylethanol1517-69-756 % similar Bis(4-fluorophenyl)methanol365-24-256 % similar 1-Phenylethanol98-85-156 % similar 4-Amino-α-methylbenzenemethanol14572-89-556 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

(-)-1-(4-Fluorophenyl)ethanol101219-73-2 1-Fluoro-4-methoxy-2-methylbenzene2338-54-7 4-Fluoro-1-methoxy-2-methylbenzene399-54-2 3-Fluoro-α-methylbenzenemethanol402-63-1 1-(4-Fluorophenyl)ethanol403-41-8 2-Fluoro-α-methylbenzenemethanol445-26-1 1-Ethoxy-2-fluorobenzene451-80-9 1-Ethoxy-3-fluorobenzene458-03-7

Elsewhere

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