ChemicalBook--->CAS DataBase List--->696-40-2

696-40-2

696-40-2 Structure

696-40-2 Structure
IdentificationMore
[Name]

3-Iodobenzylamine
[CAS]

696-40-2
[Synonyms]

3-IODOBENZYLAMINE
AURORA KA-7711
RARECHEM AL BW 0705
3-Iodobenzylamine,97%
3-IODOBENZYLAE
3-Iodobenzenemethanamine
[EINECS(EC#)]

625-616-2
[Molecular Formula]

C7H8IN
[MDL Number]

MFCD00192227
[Molecular Weight]

233.05
[MOL File]

696-40-2.mol
Chemical PropertiesBack Directory
[Appearance]

clear light yellow liquid
[Melting point ]

248-249 °C(Solv: N,N-dimethylformamide (68-12-2))
[Boiling point ]

132 °C/8 mmHg (lit.)
[density ]

1.748 g/mL at 25 °C(lit.)
[refractive index ]

1.638-1.64
[Fp ]

>230 °F
[storage temp. ]

under inert gas (nitrogen or Argon) at 2–8 °C
[form ]

Liquid
[pka]

8.79±0.10(Predicted)
[color ]

Clear light yellow
[Water Solubility ]

Difficult to mix in water.
[Sensitive ]

Air & Light Sensitive
[BRN ]

2689602
[InChI]

InChI=1S/C7H8IN/c8-7-3-1-2-6(4-7)5-9/h1-4H,5,9H2
[InChIKey]

LQLOGZQVKUNBRX-UHFFFAOYSA-N
[SMILES]

C1(CN)=CC=CC(I)=C1
[CAS DataBase Reference]

696-40-2(CAS DataBase Reference)
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)Health Hazard (GHS08)
GHS07,GHS08
[Signal word ]

Danger
[Hazard statements ]

H315-H317-H319-H334-H335-H361
[Precautionary statements ]

P201-P280-P302+P352-P305+P351+P338-P308+P313
[Hazard Codes ]

Xn
[Risk Statements ]

R36/37/38:Irritating to eyes, respiratory system and skin .
R42/43:May cause sensitization by inhalation and skin contact .
R63:Possible risk of harm to the unborn child.
[Safety Statements ]

S23:Do not breathe gas/fumes/vapor/spray (appropriate wording to be specified by the manufacturer) .
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection .
[RIDADR ]

2735
[WGK Germany ]

3
[HazardClass ]

8
[PackingGroup ]

II
[HS Code ]

29214990
[Storage Class]

11 - Combustible Solids
[Hazard Classifications]

Eye Irrit. 2
Repr. 2
Resp. Sens. 1
Skin Irrit. 2
Skin Sens. 1
STOT SE 3
Hazard InformationBack Directory
[Chemical Properties]

clear light yellow liquid
[Uses]

It is a pharmaceutical intermediate.
Spectrum DetailBack Directory
[Spectrum Detail]

3-Iodobenzylamine(696-40-2)1HNMR
3-Iodobenzylamine(696-40-2)FT-IR
3-Iodobenzylamine(696-40-2)IR
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

3-Iodobenzylamine, 98%(696-40-2)
[Alfa Aesar]

3-Iodobenzylamine, 97%(696-40-2)
[Sigma Aldrich]

696-40-2(sigmaaldrich)
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