UCSF

ZINC01648344

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 7th, 2004 11 No

Popular Name: 2-Methyl-5-nitroaniline 2-Methyl-5-nitroaniline

Find On: PubMed — Wikipedia — Google

CAS Numbers: 119-32-4 , 304851-86-3 , 99-55-8 , [99-55-8]

Download: MOL2 SDF SMILES Flexibase

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Vendors

Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 1.76 3.85 -7.09 2 4 0 72 152.153 1 ↓

Vendor Notes

Note Type Comments Provided By
MP 103-106° Oakwood Chemical
Mp [°C] 104 - 107 Acros Organics
Melting_Point 105-108? Alfa-Aesar
Melting_Point 105-108° Alfa-Aesar
MP 106 - 108 Enamine Building Blocks
MP 106...108 Enamine Building Blocks
MP 109 TCI
M.P 75-77C Indofine
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95% Fluorochem
Purity 95+% Matrix Scientific
H phrase H301: Toxic if swallowed Acros Organics
H phrase H301: Toxic if swallowed; H331: Toxic if inhaled; H351: Suspected of causing cancer; H311: Toxic in contact with skin; H412: Harmful to aquatic life with long lasting effects Acros Organics
Warnings IRRITANT Matrix Scientific
P phrase P301 + P310: IF SWALLOWED: Immediately call a POISON CENTER or doctor/physician Acros Organics
P phrase P301 + P310: IF SWALLOWED: Immediately call a POISON CENTER or doctor/physician; P280: Wear protective gloves/protective clothing/eye protection/face protection; P312: Call a POISON CENTER or doctor/physician if you feel unwell; P302 + P350: IF ON SKIN: G Acros Organics
R phrase R23/24/25: Toxic by inhalation, in contact with skin and if swallowed. Acros Organics
R phrase R23/24/25: Toxic by inhalation, in contact with skin and if swallowed.; R40: Limited evidence of a carcinogenic effect.; R52/53: Harmful to aquatic organisms, may cause long-term adverse effects in the aquatic environment. Acros Organics
S phrase S36/37: Wear suitable protective clothing and gloves. Acros Organics
S phrase S36/37: Wear suitable protective clothing and gloves.; S45: In case of accident or if you feel unwell, seek medical advice immediately (show the label where possible).; S61: Avoid release to the environment. Refer to special instructions / safety data she Acros Organics
Hazard T: Toxic Acros Organics
Warnings Toxic Matrix Scientific

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