137847
2-Methyl-3-nitrobenzoic acid
99%
Manufacturer: Sigma Aldrich
CAS Number: 1975-50-4
Synonym(S): 3-Nitro-o-toluic acid
Select a Size
| Pack Size | SKU | Availability | Price |
|---|---|---|---|
| 100 G | 137847-100-G | In Stock | ₹ 4,622.28 |
137847 - 100 G
In Stock
Quantity
1
Base Price: ₹ 4,622.28
GST (18%): ₹ 832.01
Total Price: ₹ 5,454.29
Quality Level
100
Assay
99%
form
solid
mp
182-184 °C (lit.)
SMILES string
Cc1c(cccc1[N+]([O-])=O)C(O)=O
InChI
1S/C8H7NO4/c1-5-6(8(10)11)3-2-4-7(5)9(12)13/h2-4H,1H3,(H,10,11)
InChI key
YPQAFWHSMWWPLX-UHFFFAOYSA-N
Description
- Application: 2-Methyl-3-nitrobenzoic acid was used as starting reagent in the synthesis of methyl 2-methyl-3-nitrobenzoate[1] and 2,3-unsubstituted indoles[2].
SAFETY INFORMATION
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
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Quality Level: 100
Assay: 99%
form: solid
mp: 182-184 °C (lit.)
SMILES string: Cc1c(cccc1[N+]([O-])=O)C(O)=O
InChI: 1S/C8H7NO4/c1-5-6(8(10)11)3-2-4-7(5)9(12)13/h2-4H,1H3,(H,10,11)
InChI key: YPQAFWHSMWWPLX-UHFFFAOYSA-N
Quality Level:
100
Assay:
99%
form:
solid
mp:
182-184 °C (lit.)
SMILES string:
Cc1c(cccc1[N+]([O-])=O)C(O)=O
InChI:
1S/C8H7NO4/c1-5-6(8(10)11)3-2-4-7(5)9(12)13/h2-4H,1H3,(H,10,11)
InChI key:
YPQAFWHSMWWPLX-UHFFFAOYSA-N
Quality Level: __
Assay: __
form: __
mp: __
SMILES string: __
InChI: 1S/C17H16F6N2O/c18-16(19,20)11-5-3-4-9-10(15(26)12-6-1-2-7-24-12)8-13(17(21,22)23)25-14(9)11/h3-5,8,12,15,24,26H,1-2,6-7H2/t12-,15-/m0/s1
InChI key: XEEQGYMUWCZPDN-WFASDCNBSA-N
Quality Level:
__
Assay:
__
form:
__
mp:
__
SMILES string:
__
InChI:
1S/C17H16F6N2O/c18-16(19,20)11-5-3-4-9-10(15(26)12-6-1-2-7-24-12)8-13(17(21,22)23)25-14(9)11/h3-5,8,12,15,24,26H,1-2,6-7H2/t12-,15-/m0/s1
InChI key:
XEEQGYMUWCZPDN-WFASDCNBSA-N
Quality Level: __
Assay: __
form: __
mp: __
SMILES string: __
InChI: 1S/C20H25N7O6.Ca/c1-27-12(9-23-16-15(27)18(31)26-20(21)25-16)8-22-11-4-2-10(3-5-11)17(30)24-13(19(32)33)6-7-14(28)29;/h2-5,12-13,22H,6-9H2,1H3,(H,24,30)(H,28,29)(H,32,33)(H4,21,23,25,26,31);/q;+2/p-2/t12?,13-;/m0./s1
InChI key: VWBBRFHSPXRJQD-ZEDZUCNESA-L
Quality Level:
__
Assay:
__
form:
__
mp:
__
SMILES string:
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InChI:
1S/C20H25N7O6.Ca/c1-27-12(9-23-16-15(27)18(31)26-20(21)25-16)8-22-11-4-2-10(3-5-11)17(30)24-13(19(32)33)6-7-14(28)29;/h2-5,12-13,22H,6-9H2,1H3,(H,24,30)(H,28,29)(H,32,33)(H4,21,23,25,26,31);/q;+2/p-2/t12?,13-;/m0./s1
InChI key:
VWBBRFHSPXRJQD-ZEDZUCNESA-L
Quality Level: __
Assay: __
form: __
mp: __
SMILES string: [H][C@]12CC[C@@]3(C)[C@@]([H])(CC[C@]3(OC(C)=O)C(C)=O)[C@]1([H])C=C(C)C4=CC(=O)CC[C@]24C
InChI: 1S/C24H32O4/c1-14-12-18-19(22(4)9-6-17(27)13-21(14)22)7-10-23(5)20(18)8-11-24(23,15(2)25)28-16(3)26/h12-13,18-20H,6-11H2,1-5H3/t18-,19+,20+,22-,23+,24+/m1/s1
InChI key: RQZAXGRLVPAYTJ-GQFGMJRRSA-N
Quality Level:
__
Assay:
__
form:
__
mp:
__
SMILES string:
[H][C@]12CC[C@@]3(C)[C@@]([H])(CC[C@]3(OC(C)=O)C(C)=O)[C@]1([H])C=C(C)C4=CC(=O)CC[C@]24C
InChI:
1S/C24H32O4/c1-14-12-18-19(22(4)9-6-17(27)13-21(14)22)7-10-23(5)20(18)8-11-24(23,15(2)25)28-16(3)26/h12-13,18-20H,6-11H2,1-5H3/t18-,19+,20+,22-,23+,24+/m1/s1
InChI key:
RQZAXGRLVPAYTJ-GQFGMJRRSA-N