136883
4-Methyl-3,5-dinitrobenzoic acid
98%
Manufacturer: Sigma Aldrich
CAS Number: 16533-71-4
Synonym(S): 3,5-Dinitro-4-methylbenzoic acid, 3,5-Dinitro-p-toluic acid
Select a Size
| Pack Size | SKU | Availability | Price |
|---|---|---|---|
| 25 G | 136883-25-G | In Stock | ₹ 10,889.95 |
| 500 G | 136883-500-G | In Stock | ₹ 11,496.15 |
136883 - 25 G
In Stock
Quantity
1
Base Price: ₹ 10,889.95
GST (18%): ₹ 1,960.191
Total Price: ₹ 12,850.141
Quality Level
100
Assay
98%
form
solid
mp
155-158 °C (lit.)
solubility
methanol: soluble 250 mg/10 mL, clear, faintly yellow to yellow
SMILES string
Cc1c(cc(cc1[N+]([O-])=O)C(O)=O)[N+]([O-])=O
InChI
1S/C8H6N2O6/c1-4-6(9(13)14)2-5(8(11)12)3-7(4)10(15)16/h2-3H,1H3,(H,11,12)
InChI key
LZWWZQXBKVZKIP-UHFFFAOYSA-N
Other Options
| Image | Product Name | Manufacturer | Price Range | |
|---|---|---|---|---|
 | Benzoic acid, 4-methyl-3,5-dinitro- | Aaron Chemicals LLC | ₹ 427.80 - ₹ 8,556.00 |
Related Products
Description
- Application: 4-Methyl-3,5-dinitrobenzoic acid was used in characterization of the range of highly polar nitroaromatic compounds in water samples from a trinitrotoluene-contaminated waste disposal site[1]. It was used as starting reagent for the asymmetric synthesis of the benzazocine core of FR900482[2].
SAFETY INFORMATION
Pictograms
Signal Word
Warning
Hazard Statements
Precautionary Statements
P261 - P264 - P271 - P280 - P302 + P352 - P305 + P351 + P338
Hazard Classifications
Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3
Target Organs
Respiratory system
WGK
WGK 3
Flash Point(F)
Not applicable
Flash Point(C)
Not applicable
Personal Protective Equipment
dust mask type N95 (US), Eyeshields, Gloves
Compare Similar Items
Show Difference
Quality Level: 100
Assay: 98%
form: solid
mp: 155-158 °C (lit.)
solubility: methanol: soluble 250 mg/10 mL, clear, faintly yellow to yellow
SMILES string: Cc1c(cc(cc1[N+]([O-])=O)C(O)=O)[N+]([O-])=O
InChI: 1S/C8H6N2O6/c1-4-6(9(13)14)2-5(8(11)12)3-7(4)10(15)16/h2-3H,1H3,(H,11,12)
InChI key: LZWWZQXBKVZKIP-UHFFFAOYSA-N
Quality Level:
100
Assay:
98%
form:
solid
mp:
155-158 °C (lit.)
solubility:
methanol: soluble 250 mg/10 mL, clear, faintly yellow to yellow
SMILES string:
Cc1c(cc(cc1[N+]([O-])=O)C(O)=O)[N+]([O-])=O
InChI:
1S/C8H6N2O6/c1-4-6(9(13)14)2-5(8(11)12)3-7(4)10(15)16/h2-3H,1H3,(H,11,12)
InChI key:
LZWWZQXBKVZKIP-UHFFFAOYSA-N
Quality Level: 100
Assay: 95%
form: flakes
mp: 97-103 °C (lit.)
solubility: __
SMILES string: [H][C@@]12CC=CC[C@]1([H])C(=O)OC2=O
InChI: 1S/C8H8O3/c9-7-5-3-1-2-4-6(5)8(10)11-7/h1-2,5-6H,3-4H2/t5-,6+
InChI key: KMOUUZVZFBCRAM-OLQVQODUSA-N
Quality Level:
100
Assay:
95%
form:
flakes
mp:
97-103 °C (lit.)
solubility:
__
SMILES string:
[H][C@@]12CC=CC[C@]1([H])C(=O)OC2=O
InChI:
1S/C8H8O3/c9-7-5-3-1-2-4-6(5)8(10)11-7/h1-2,5-6H,3-4H2/t5-,6+
InChI key:
KMOUUZVZFBCRAM-OLQVQODUSA-N
Quality Level: __
Assay: __
form: __
mp: 618 °C (lit.)
solubility: __
SMILES string: [Li+].[Li+].[O-]C([O-])=O
InChI: 1S/CH2O3.2Li/c2-1(3)4;;/h(H2,2,3,4);;/q;2*+1/p-2
InChI key: XGZVUEUWXADBQD-UHFFFAOYSA-L
Quality Level:
__
Assay:
__
form:
__
mp:
618 °C (lit.)
solubility:
__
SMILES string:
[Li+].[Li+].[O-]C([O-])=O
InChI:
1S/CH2O3.2Li/c2-1(3)4;;/h(H2,2,3,4);;/q;2*+1/p-2
InChI key:
XGZVUEUWXADBQD-UHFFFAOYSA-L
Quality Level: 100
Assay: 98%
form: solid
mp: 22-25 °C (lit.)
solubility: alcohol: freely solublediethyl ether: freely solublewater: insoluble
SMILES string: COc1ccc(CO)cc1
InChI: 1S/C8H10O2/c1-10-8-4-2-7(6-9)3-5-8/h2-5,9H,6H2,1H3
InChI key: __
Quality Level:
100
Assay:
98%
form:
solid
mp:
22-25 °C (lit.)
solubility:
alcohol: freely solublediethyl ether: freely solublewater: insoluble
SMILES string:
COc1ccc(CO)cc1
InChI:
1S/C8H10O2/c1-10-8-4-2-7(6-9)3-5-8/h2-5,9H,6H2,1H3
InChI key:
__