Name: 1-DIMETHYLAMINO-BUT-1-EN-3-ONE, 98
SKU: 2802-08-6

Products Categories

Pharmaceutical (7)
Organic Chemicals (4)
Others (2)
Basic Inorganic Chemicals (2)

Basic Information

Molecular Structure:
CAS No.:	2802-08-6
Name:	1-DIMETHYLAMINO-BUT-1-EN-3-ONE, 98
Article Data:	2

Formula:	C₆H₁₁NO
Molecular Weight:	113.159
Synonyms:	3-Buten-2-one,4-(dimethylamino)-, (E)- (8CI);(E)-4-Dimethylamino-3-buten-2-one;trans-4-(Dimethylamino)-3-buten-2-one;Methyl β-(N,N-dimethylamino)vinyl ketone;
Density:	0.901 g/cm³
Boiling Point:	169.2 °C at 760 mmHg
Flash Point:	54.3 °C
Appearance:	clear reddish-brown to dark brown liquid
Hazard Symbols:	Xi
Risk Codes:	36/37/38
Safety:	26-36
PSA:	20.31000
LogP:	0.65070

Country:
Business Type:
All

Lab/Research institutions

Trading Company

Manufacturers

Other
Certificate:
Manufacturer

Enterprise Authentication

ISO

GMP

FDA

HALAL

Display:default sort
Suppiers of more reward points first

New supplier

Total:12 Page 1 of 1 1

Post a RFQ

Cas No.:

Product Name:

Quantity:

Email:

Company name:

Valid Period:

Detailed Requirements:

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)

What can I do for you?
Get Best Price

Get Best Price for 2802-08-6

Specification

The 3-Buten-2-one,4-(dimethylamino)-, (3E)-, with the CAS registry number 2802-08-6, is also known as Methyl β-(N,N-dimethylamino)vinyl ketone. It belongs to the product categories of Acetylgroup; C₃ to C₆; Carbonyl Compounds; Ketones. This chemical's molecular formula is C₆H₁₁NO and formula weight is 113.16. What's more, its IUPAC name is (E)-4-(dimethylamino)but-3-en-2-one. It is used as organic reagents and pharmaceutical intermediates.

Physical properties of 3-Buten-2-one,4-(dimethylamino)-, (3E)- are: (1)ACD/LogP: 0.46; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 2; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 2; (6)Polar Surface Area: 20.31 Å²; (7)Index of Refraction: 1.448; (8)Molar Refractivity: 33.65 cm³; (9)Molar Volume: 125.5 cm³; (10)Surface Tension: 27.9 dyne/cm; (11)Density: 0.901 g/cm³; (12)Flash Point: 54.3 °C; (13)Enthalpy of Vaporization: 40.56 kJ/mol; (14)Boiling Point: 169.2 °C at 760 mmHg; (15)Vapour Pressure: 1.56 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
It is irritating to eyes, respiratory system and skin. In case of contact with eyes, you should rinse immediately with plenty of water and seek medical advice. When using it, you need wear suitable protective clothing.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: CC(=O)C=CN(C)C
(2)Isomeric SMILES: CC(=O)/C=C/N(C)C
(3)InChI: InChI=1S/C6H11NO/c1-6(8)4-5-7(2)3/h4-5H,1-3H3/b5-4+
(4)InChIKey: QPWSKIGAQZAJKS-SNAWJCMRSA-N