m-Phthalate esters

Description:

Ester derivatives of m-phthalic acids, which are based on a benzene 1,3-dicarboxylic acid skeleton.

Ancestors:

Organic compounds ⮕ Benzenoids ⮕ Benzene and substituted derivatives ⮕ Benzoic acids and derivatives ⮕ Phthalic acid and derivatives ⮕ Phthalate esters ⮕ m-Phthalate esters

3，6，9，12，15-Pentaoxabicyclo[15.3.1]heneicosa-1(21)，17，19-triene-2，16-dione
- ≥95%
Cas Number: 65745-83-7

Formula: C₁₆H₂₀O₇ Molecular Weight: 324.3258

SMILES: C1COCCOC(=O)C2=CC(=CC=C2)C(=O)OCCOCCO1

InChIKey: HZYZWGYPBXBALT-UHFFFAOYSA-N

InChI: InChI=1S/C16H20O7/c17-15-13-2-1-3-14(12-13)16(18)23-11-9-21-7-5-19-4-6-20-8-10-22-15/h1-3,12H,4-11H2
Details

Pricing Close
3-(Methoxycarbonyl)-4-nitrobenzoic Acid
- ≥97%
Cas Number: 64152-09-6 Compound CID: 12350518

Formula: C₉H₇NO₆ Molecular Weight: 225.156

IUPAC Name: 3-methoxycarbonyl-4-nitrobenzoic acid

SMILES: COC(=O)C1=C(C=CC(=C1)C(=O)O)[N+](=O)[O-]

InChIKey: KRACQAXEQJJYLE-UHFFFAOYSA-N

InChI: InChI=1S/C9H7NO6/c1-16-9(13)6-4-5(8(11)12)2-3-7(6)10(14)15/h2-4H,1H3,(H,11,12)
Details

Pricing Close
3-(Methoxycarbonyl)-2-nitrobenzoic acid
- ≥97%
Cas Number: 861593-27-3 Compound CID: 24729180

Formula: C₉H₇NO₆ Molecular Weight: 225.15

IUPAC Name: 3-methoxycarbonyl-2-nitrobenzoic acid

SMILES: COC(=O)C1=CC=CC(=C1[N+](=O)[O-])C(=O)O

InChIKey: NUULGBPUCNUUQD-UHFFFAOYSA-N

InChI: InChI=1S/C9H7NO6/c1-16-9(13)6-4-2-3-5(8(11)12)7(6)10(14)15/h2-4H,1H3,(H,11,12)
Details

Pricing Close
2-Chloro-5-(methoxycarbonyl)benzoic acid
- ≥95%
Cas Number: 651058-97-8 EC Number: 845-665-5 Compound CID: 67215037

IUPAC Name: 2-chloro-5-methoxycarbonylbenzoic acid

SMILES: COC(=O)C1=CC(=C(C=C1)Cl)C(=O)O

InChIKey: YHXPAIMKXLFOOT-UHFFFAOYSA-N

InChI: InChI=1S/C9H7ClO4/c1-14-9(13)5-2-3-7(10)6(4-5)8(11)12/h2-4H,1H3,(H,11,12)
Details

Pricing Close
Monomethyl 5-amino isophthalate
- ≥97%
Cas Number: 28179-47-7 Compound CID: 13557643

Formula: C₉H₉NO₄ Molecular Weight: 195.17

IUPAC Name: 3-amino-5-methoxycarbonylbenzoic acid

SMILES: COC(=O)C1=CC(=CC(=C1)C(=O)O)N

InChIKey: QGGKQIDRZUUHAR-UHFFFAOYSA-N

InChI: InChI=1S/C9H9NO4/c1-14-9(13)6-2-5(8(11)12)3-7(10)4-6/h2-4H,10H2,1H3,(H,11,12)
Details

Pricing Close
5-(Methoxycarbonyl)-2-nitrobenzoic Acid
- ≥97%
Cas Number: 76143-33-4 Compound CID: 14938098

Formula: C₉H₇NO₆ Molecular Weight: 225.15g/mol

IUPAC Name: 5-methoxycarbonyl-2-nitrobenzoic acid

SMILES: COC(=O)C1=CC(=C(C=C1)[N+](=O)[O-])C(=O)O

InChIKey: MJSJVFTZSILELE-UHFFFAOYSA-N

InChI: InChI=1S/C9H7NO6/c1-16-9(13)5-2-3-7(10(14)15)6(4-5)8(11)12/h2-4H,1H3,(H,11,12)
Details

Pricing Close
3-Fluoro-5-(methoxycarbonyl)benzoic Acid
- ≥95%
Cas Number: 660416-36-4 EC Number: 852-735-9 Compound CID: 24728920

Formula: C₉H₇FO₄ Molecular Weight: 198.15

IUPAC Name: 3-fluoro-5-methoxycarbonylbenzoic acid

SMILES: COC(=O)C1=CC(=CC(=C1)C(=O)O)F

InChIKey: SFUQWJIUIYAPDJ-UHFFFAOYSA-N

InChI: InChI=1S/C9H7FO4/c1-14-9(13)6-2-5(8(11)12)3-7(10)4-6/h2-4H,1H3,(H,11,12)
Details

Pricing Close
2-Hydroxy-5-(methoxycarbonyl)benzoic acid
- ≥97%
Cas Number: 79128-78-2 Compound CID: 12717060

Formula: C₉H₈O₅ Molecular Weight: 196.16

IUPAC Name: 2-hydroxy-5-methoxycarbonylbenzoic acid

SMILES: COC(=O)C1=CC(=C(C=C1)O)C(=O)O

InChIKey: LIQLYTSJSBMCAH-UHFFFAOYSA-N

InChI: InChI=1S/C9H8O5/c1-14-9(13)5-2-3-7(10)6(4-5)8(11)12/h2-4,10H,1H3,(H,11,12)
Details

Pricing Close
Dimethyl 2-Nitroisophthalate
- ≥97%
Cas Number: 57052-99-0 Compound CID: 12217542

Formula: C₁₀H₉NO₆ Molecular Weight: 239.18

IUPAC Name: dimethyl 2-nitrobenzene-1,3-dicarboxylate

SMILES: COC(=O)C1=C(C(=CC=C1)C(=O)OC)[N+](=O)[O-]

InChIKey: UZMFVOACDBUXRK-UHFFFAOYSA-N

InChI: InChI=1S/C10H9NO6/c1-16-9(12)6-4-3-5-7(10(13)17-2)8(6)11(14)15/h3-5H,1-2H3
Details

Pricing Close
Diethyl 5-hydroxyisophthalate
- ≥95%
Cas Number: 39630-68-7 Compound CID: 606456

Formula: C₁₂H₁₄O₅ Molecular Weight: 238.24

IUPAC Name: diethyl 5-hydroxybenzene-1,3-dicarboxylate

SMILES: CCOC(=O)C1=CC(=CC(=C1)O)C(=O)OCC

InChIKey: PUZBTHGPBGQFLW-UHFFFAOYSA-N

InChI: InChI=1S/C12H14O5/c1-3-16-11(14)8-5-9(7-10(13)6-8)12(15)17-4-2/h5-7,13H,3-4H2,1-2H3
Details

Pricing Close
Diethyl 5-Bromoisophthalate
- ≥98%
Cas Number: 127437-29-0 Compound CID: 182853

Formula: C₁₂H₁₃BrO₄ Molecular Weight: 301.13

IUPAC Name: diethyl 5-bromobenzene-1,3-dicarboxylate

SMILES: CCOC(=O)C1=CC(=CC(=C1)Br)C(=O)OCC

InChIKey: ZDFHATYWKREQJF-UHFFFAOYSA-N

InChI: InChI=1S/C12H13BrO4/c1-3-16-11(14)8-5-9(7-10(13)6-8)12(15)17-4-2/h5-7H,3-4H2,1-2H3
Details

Pricing Close
Dibutyl isophthalate
- ≥95%
Cas Number: 3126-90-7 Compound CID: 18405

Formula: C₁₆H₂₂O₄ Molecular Weight: 278.34

IUPAC Name: dibutyl benzene-1,3-dicarboxylate

SMILES: CCCCOC(=O)C1=CC(=CC=C1)C(=O)OCCCC

InChIKey: GOPWOUQJIMLDDM-UHFFFAOYSA-N

InChI: InChI=1S/C16H22O4/c1-3-5-10-19-15(17)13-8-7-9-14(12-13)16(18)20-11-6-4-2/h7-9,12H,3-6,10-11H2,1-2H3
Details

Pricing Close

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