CAS No.: 131-16-8 — Dipropyl phthalate (邻苯二甲酸二丙酯)

1. Primary Information

English name:	Dipropyl phthalate
CAS No.:	131-16-8
Molecular formula:	C₁₄H₁₈O₄
Molecular weight:	250.29 g/mol
SMILES:	CCCOC(=O)C1=CC=CC=C1C(=O)OCCC
Structural class:
Other identifiers:	di-n-propylphthalate Di-PrP

2. Suppliers & Pricing

Supplier	Pack size	Purity	Price (CNY)	Storage conditions	Lead time	Notes
Kehua Intelligence	1ml	GC≥99%	528	2-8℃	in stock	-
Kehua Intelligence	5ml	98%	128	2-8℃	in stock	-
Kehua Intelligence	25ml	98%	296	2-8℃	in stock	-
Kehua Intelligence	100ml	98%	960	2-8℃	in stock	-

3. Structures

3.1 2D structure

3.2 3D structure

-1 -2 -3 36 36 0 0 0 0 0 0 0999 V2000 -2.1249 -0.4862 -0.2773 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3207 -0.3067 -0.1000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0364 0.2539 1.9006 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7182 -0.7477 1.4925 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8228 1.3935 0.1938 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5583 1.2063 0.1357 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3527 -2.3705 -1.1218 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2570 -1.6312 -0.6173 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0019 -1.5495 0.1097 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0196 -1.5038 0.2579 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3837 2.5905 -0.2515 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3784 2.2162 -0.3678 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7059 0.3576 0.7135 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1743 -0.0326 0.5926 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2960 -3.5125 -0.7895 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0437 -2.8910 -0.3032 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5635 3.6003 -0.7549 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8175 3.4132 -0.8130 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4348 -2.7644 -1.5744 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8070 -1.7209 -1.8795 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8948 -0.7495 -0.4825 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9619 -1.6303 -1.6735 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9099 -1.1235 0.5519 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4988 -2.1785 0.8532 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3583 -2.3647 0.1062 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3070 -1.4510 1.3144 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4585 2.7484 -0.2113 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4589 2.1090 -0.4138 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2355 -3.1364 -0.3722 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5305 -4.0856 -1.6918 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8450 -4.1945 -0.0616 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4350 -3.7854 -0.4699 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9270 -2.9568 -0.9461 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3806 -2.8935 0.7383 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0000 4.5327 -1.1008 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4560 4.2011 -1.2019 H 0 0 0 0 0 0 0 0 0 0 0 0 1 9 1 0 0 0 0 1 13 1 0 0 0 0 2 10 1 0 0 0 0 2 14 1 0 0 0 0 3 13 2 0 0 0 0 4 14 2 0 0 0 0 5 6 1 0 0 0 0 5 11 2 0 0 0 0 5 13 1 0 0 0 0 6 12 2 0 0 0 0 6 14 1 0 0 0 0 7 9 1 0 0 0 0 7 15 1 0 0 0 0 7 19 1 0 0 0 0 7 20 1 0 0 0 0 8 10 1 0 0 0 0 8 16 1 0 0 0 0 8 21 1 0 0 0 0 8 22 1 0 0 0 0 9 23 1 0 0 0 0 9 24 1 0 0 0 0 10 25 1 0 0 0 0 10 26 1 0 0 0 0 11 17 1 0 0 0 0 11 27 1 0 0 0 0 12 18 1 0 0 0 0 12 28 1 0 0 0 0 15 29 1 0 0 0 0 15 30 1 0 0 0 0 15 31 1 0 0 0 0 16 32 1 0 0 0 0 16 33 1 0 0 0 0 16 34 1 0 0 0 0 17 18 2 0 0 0 0 17 35 1 0 0 0 0 18 36 1 0 0 0 0

4. International Nomenclature & Identifiers

4.1 IUPAC Name

dipropyl benzene-1,2-dicarboxylate

4.2 InChI

InChI=1S/C14H18O4/c1-3-9-17-13(15)11-7-5-6-8-12(11)14(16)18-10-4-2/h5-8H,3-4,9-10H2,1-2H3

1. Primary Information

2. Suppliers & Pricing

3. Structures

3.1 2D structure

3.2 3D structure

4. International Nomenclature & Identifiers

4.1 IUPAC Name

4.2 InChI

4.3 InChIKey

4.4 Canonical SMILES

4.5 Isomeric SMILES

4.6 SDF file

5. Spectroscopic data

5.1 ¹³C nuclear magnetic resonance (¹³C NMR)

5.2 ¹H nuclear magnetic resonance (¹H NMR)

5.3 Mass spectrometry (MS)

5.4 Infrared spectroscopy (IR)

5.5 Ultraviolet/visible spectroscopy (UV/Vis)

1. Primary Information

2. Suppliers & Pricing

3. Structures

3.1 2D structure

3.2 3D structure

4. International Nomenclature & Identifiers

4.1 IUPAC Name

4.2 InChI

4.3 InChIKey

4.4 Canonical SMILES

4.5 Isomeric SMILES

4.6 SDF file

5. Spectroscopic data

5.1 13C nuclear magnetic resonance (13C NMR)

5.2 1H nuclear magnetic resonance (1H NMR)

5.3 Mass spectrometry (MS)

5.4 Infrared spectroscopy (IR)

5.5 Ultraviolet/visible spectroscopy (UV/Vis)

5.1 ¹³C nuclear magnetic resonance (¹³C NMR)

5.2 ¹H nuclear magnetic resonance (¹H NMR)