Welcome to LookChem.com Sign In|Join Free
  • or
Home > Products >  > 

2-Butenedioic acid(2Z)-, diheptyl ester (9CI)

Related Products

Hot Products

Basic Information Post buying leads Suppliers
Name

2-Butenedioic acid(2Z)-, diheptyl ester (9CI)

EINECS 250-884-9
CAS No. 31983-42-3 Density 0.957 g/cm3
PSA 52.60000 LogP 4.56980
Solubility N/A Melting Point N/A
Formula C18H32O4 Boiling Point 389.2 °C at 760 mmHg
Molecular Weight 312.45 Flash Point 181.8 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 31983-42-3 (diheptyl maleate) Hazard Symbols N/A
Synonyms

2-Butenedioicacid (Z)-, diheptyl ester;Maleic acid, diheptyl ester (6CI,7CI,8CI);Bis(1-heptyl) maleate;Di-n-heptyl maleate;Diheptyl maleate;

 

2-Butenedioic acid(2Z)-, diheptyl ester (9CI) Specification

The 2-Butenedioic acid(2Z)-, diheptyl ester (9CI), with the CAS registry number 31983-42-3, is also known as Diheptyl maleate. Its EINECS registry number is 250-884-9. This chemical's molecular formula is C18H32O4 and molecular weight is 312.44428. Its IUPAC name is called diheptyl (Z)-but-2-enedioate.

Physical properties of 2-Butenedioic acid(2Z)-, diheptyl ester (9CI): (1)ACD/LogP: 7.00; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 7; (4)ACD/LogD (pH 7.4): 7; (5)ACD/BCF (pH 5.5): 122264.08; (6)ACD/BCF (pH 7.4): 122264.08; (7)ACD/KOC (pH 5.5): 152428.73; (8)ACD/KOC (pH 7.4): 152428.73; (9)#H bond acceptors: 4; (10)#Freely Rotating Bonds: 16; (11)Index of Refraction: 1.458; (12)Molar Refractivity: 89.04 cm3; (13)Molar Volume: 326.2 cm3; (14)Surface Tension: 33.5 dyne/cm; (15)Density: 0.957 g/cm3; (16)Flash Point: 181.8 °C; (17)Enthalpy of Vaporization: 63.85 kJ/mol; (18)Boiling Point: 389.2 °C at 760 mmHg; (19)Vapour Pressure: 2.91E-06 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: CCCCCCCOC(=O)C=CC(=O)OCCCCCCC
(2)Isomeric SMILES: CCCCCCCOC(=O)/C=C\C(=O)OCCCCCCC
(3)InChI: InChI=1S/C18H32O4/c1-3-5-7-9-11-15-21-17(19)13-14-18(20)22-16-12-10-8-6-4-2/h13-14H,3-12,15-16H2,1-2H3/b14-13-
(4)InChIKey: KUUZQLFCCOGXKQ-YPKPFQOOSA-N

Post a RFQ

Enter 15 to 2000 letters.Word count: 0 letters

Attach files(File Format: Jpeg, Jpg, Gif, Png, PDF, PPT, Zip, Rar,Word or Excel Maximum File Size: 3MB)

1

What can I do for you?
Get Best Price

Get Best Price for 31983-42-3