CAS 367-31-7|CAS 302-17-0|4-fluorobenzene-1,2-diamine|1,2-Diamino-4-fluorobenzene|4-fluorobenzene-1,2-diamine|4-Fluorobenzene-1,2-diamine, tech|3,4-Diaminofluorobenzene|4-Fluorophenylene-1,2-diamine...

General Information

Structure

Molecular Formula

C₆H₇FN₂

Molecular Mass

126.1315832

Exact Mass

126.05932645

Charge

InChI

InChI=1S/C6H7FN2/c7-4-1-2-5(8)6(9)3-4/h1-3H,8-9H2

InChIKey

KWEWNOOZQVJONF-UHFFFAOYSA-N

Canonic Smiles

Fc1ccc(c(c1)N)N

Isomeric Smiles

c1(F)cc(N)c(N)cc1

Calculated Properties

JChem

H Acceptors

H Donor

LogD (pH = 5.5)

0.4510446

LogD (pH = 7.4)

0.45800635

Log P

0.45809585

Molar Refractivity

35.6752

Polarizability

12.292027

Polar Surface Area

52.04

Rotatable Bonds

Lipinski's Rule of Five

true

Data Source

Names and Identifiers

IUPAC name

4-fluorobenzene-1,2-diamine

Synonyms

1,2-Diamino-4-fluorobenzene4-Fluorobenzene-1,2-diamine, tech3,4-Diaminofluorobenzene4-Fluorophenylene-1,2-diamine4-fluorobenzene-1,2-diamine4-FLUORO-o-PHENYLENEDIAMINE4-Fluoro-o-phenylenediamine4-Fluoro-1,2-phenylenediamine对氟邻苯二胺3,4-二氨基氟苯1,2-Diamino-4-fluorobenzene4-氟-1,2-苯二胺U - Chloral hydrate solution水合氯醛溶液4-Fluorobenzene-1,2-diamine 97%对氟邻苯二胺4-Fluoro-o-phenylenediamine

IUPAC Traditional name

4-fluorobenzene-1,2-diamine

Names and Identifiers

Registration numbers

CAS Number

367-31-7302-17-0

PubChem CID

164584

MDL Number

MFCD00042228

PubChem SID

1609720782488396724870898