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Fórmula lineal:
C6H5NHCH3
Número CAS:
Peso molecular:
107.15
UNSPSC Code:
12352100
NACRES:
NA.22
PubChem Substance ID:
EC Number:
202-870-9
Beilstein/REAXYS Number:
741982
MDL number:
Assay:
≥98.0% (GC)
Servicio técnico
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purum
Quality Level
assay
≥98.0% (GC)
refractive index
n20/D 1.571
bp
196 °C (lit.)
mp
−57 °C (lit.)
density
0.989 g/mL at 25 °C (lit.)
functional group
amine
SMILES string
CNc1ccccc1
InChI
1S/C7H9N/c1-8-7-5-3-2-4-6-7/h2-6,8H,1H3
InChI key
AFBPFSWMIHJQDM-UHFFFAOYSA-N
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signalword
Danger
Hazard Classifications
Acute Tox. 3 Dermal - Acute Tox. 3 Inhalation - Acute Tox. 3 Oral - Aquatic Acute 1 - Aquatic Chronic 1 - Eye Irrit. 2 - STOT RE 2 Oral
target_organs
Liver,spleen,Bone marrow
Clase de almacenamiento
6.1C - Combustible acute toxic Cat.3 / toxic compounds or compounds which causing chronic effects
wgk
WGK 3
flash_point_f
185.0 °F - closed cup
flash_point_c
85 °C - closed cup
ppe
Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter
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S Ramalingam et al.
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The FTIR and FTRaman spectra of 2-bromo-4-methyl aniline (2-B-4-MA) molecule have been recorded using Brucker IFS 66V spectrometer in the range of 4000-100 cm(-1). The molecular geometry and vibrational frequencies in the ground state are calculated using the Hartree-Fock (HF)
V Kameshwara Rao et al.
Bioorganic & medicinal chemistry letters, 21(12), 3511-3514 (2011-05-27)
An efficient and economical method was developed for the synthesis of 3-substituted indoles by one-pot three-component coupling reaction of a substituted or unsubstituted benzaldehyde, N-methylaniline, and indole or N-methylindole using Yb(OTf)(3)-SiO(2) as a catalyst. All the synthesized compounds were evaluated


