CAS 1200-27-7|4-Fluorophenyl-2-methyl-2-aminopropane|1-(4-fluorophenyl)-2-methylpropan-2-amine|1-(4-fluorophenyl)-2-methylpropan-2-amine|1-(4-Fluorophenyl)-2-methyl-2-aminopropane 97%|1-(4-Fluorophe...

General Information

Structure

Molecular Formula

C₁₀H₁₄FN

Molecular Mass

167.2232632

Exact Mass

167.11102767

Charge

InChI

InChI=1S/C10H14FN/c1-10(2,12)7-8-3-5-9(11)6-4-8/h3-6H,7,12H2,1-2H3

InChIKey

JITFIYFVPMQJOK-UHFFFAOYSA-N

Canonic Smiles

CC(Cc1ccc(cc1)F)(N)C

Isomeric Smiles

c1c(ccc(c1)CC(C)(C)N)F

Calculated Properties

JChem

H Acceptors

H Donor

LogD (pH = 5.5)

-0.7974007

LogD (pH = 7.4)

-0.40598533

Log P

2.227529

Molar Refractivity

48.5598

Polarizability

18.789768

Polar Surface Area

26.02

Rotatable Bonds

Lipinski's Rule of Five

true

Data Source

Names and Identifiers

Synonyms

4-Fluorophenyl-2-methyl-2-aminopropane1-(4-Fluorophenyl)-2-methyl-2-aminopropane 97%1-(4-Fluorophenyl)-2-methylpropan-2-amine2-Amino-1-(4-fluorophenyl)-2-methylpropane1-(4-Fluorophenyl)-2-methyl-2-propylamine1-(4-氟苯基)-2-甲基-2-丙基胺1,1-Dimethyl-2-(4-fluorophenyl)ethylamine

IUPAC Traditional name

1-(4-fluorophenyl)-2-methylpropan-2-amine

IUPAC name

1-(4-fluorophenyl)-2-methylpropan-2-amine

Names and Identifiers

Registration numbers

PubChem SID

160975268

PubChem CID

518471

CAS Number

1200-27-7