N-Isopropylaniline | CAS No. 768-52-5

N-Isopropylaniline

Basic Information

CAS Number

768-52-5

Molecular Formula

C9H13N

Molecular Weight

135.21 g/mol

AD

Basic Physical Properties

Melting Point

-32°C

Boiling Point

213°C

Density

0.934 g/mL at 25 °C

Water Solubility

<0.01 g/100 mL at 21 ºC

Refractive Index

n20/D 1.539(lit.)

CC(C)NC1=CC=CC=C1

InChI

InChI=1S/C9H13N/c1-8(2)10-9-6-4-3-5-7-9/h3-8,10H,1-2H3

InChIKey

FRCFWPVMFJMNDP-UHFFFAOYSA-N

LogP

2.506900000000001

pKa

5.77(at 25℃)

Topological Polar Surface Area

12.03 Ų

Hydrogen Bond Donor/Acceptor

1 / 1

Complexity

82.7

Safety Information

View Safety Information

GHS Hazard Pictograms

H302H302
H315H315
H319H319
H330H330
H335H335

Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral
H315 Causes skin irritation
Skin corrosion/irritation
H319 Causes serious eye irritation
Serious eye damage/eye irritation
H330 Fatal if inhaled
Acute toxicity, inhalation
H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

Hazard Class

Class Comb liq Class Comb liq

Synonyms & References

English

  • Tox21_200360
  • MLS002415756
  • GS-3034
  • I0384
  • N-ISOPROPYLANILINE
  • 2-(Phenylamino)propane
  • N-(2-propyl)aniline
  • N-ISOPROPYLANILINE [HSDB]
  • N-(1-Methylethyl)benzenamine
  • N-IPA
  • isopropyl-phenyl-amine
  • Benzenamine,N-(1-methylethyl)-
  • EN300-19744
  • N-Isopropylaniline, PESTANAL(R), analytical standard
  • Isopropylaniline
  • N-Phenylisopropylamine
  • CS-W019925
  • I7Y9616F3R
  • NCGC00257914-01
  • N-Isopropyl-N-phenylamine
  • UNII-I7Y9616F3R
  • SMR001370916
  • Benzenamine, N-(1-methylethyl)-
  • FT-0632923
  • 4-12-00-00255 (Beilstein Handbook Reference)
  • SCHEMBL66892
  • D-Phenylalaninebenzylestertosylate
  • N-isopropyl-1-amino-benzene
  • AC-14912
  • EINECS 212-196-7
  • BRN 2205871

MDL Number

MFCD00026347

Customs Code

2921420090

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