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

Phthalazine,1-chloro-4-(4-pyridinylmethyl)-

Related Products

Hot Products

Basic Information Post buying leads Suppliers
Name

Phthalazine,1-chloro-4-(4-pyridinylmethyl)-

EINECS N/A
CAS No. 101094-85-3 Density 1.314 g/cm3
PSA 38.67000 LogP 3.26900
Solubility N/A Melting Point 170 °C(Solv: ethanol (64-17-5))
Formula C14H10ClN3 Boiling Point 498.6 °C at 760 mmHg
Molecular Weight 255.707 Flash Point 287 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 101094-85-3 (1-CHLORO-4-(4-PYRIDINYLMETHYL)PHTHALAZINE) Hazard Symbols N/A
Synonyms

Phthalazine,1-chloro-4-(4-pyridylmethyl)- (6CI);1-Chloro-4-(4-pyridinylmethyl)phthalazine;1-Chloro-4-[(4-pyridyl)methyl]phthalazine;

 

Phthalazine,1-chloro-4-(4-pyridinylmethyl)- Specification

The Phthalazine,1-chloro-4-(4-pyridinylmethyl)-, with its CAS registry number 101094-85-3, has the IUPAC name of 1-chloro-4-(pyridin-4-ylmethyl)phthalazine. And it has the molecular formula of C14H10ClN3 and the molecular weight of 255.7. When comes to its usage, it is often used as the pharmaceutic intermediate.

The characteristics of Phthalazine,1-chloro-4-(4-pyridinylmethyl)- are as follows: (1)ACD/LogP: 1.83; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 3; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 2; (6)Polar Surface Area: 38.67 Å2; (7)Index of Refraction: 1.668; (8)Molar Refractivity: 72.57 cm3; (9)Molar Volume: 194.5 cm3; (10)Polarizability: 28.77×10-24cm3; (11)Surface Tension: 59.5 dyne/cm; (12)Density: 1.314 g/cm3; (13)Flash Point: 287 °C; (14)Enthalpy of Vaporization: 73.77 kJ/mol; (15)Boiling Point: 498.6 °C at 760 mmHg; (16)Vapour Pressure: 1.38E-09 mmHg at 25°C; (17)Exact Mass: 255.056325; (18)MonoIsotopic Mass: 255.056325; (19)Topological Polar Surface Area: 38.7; (20)Heavy Atom Count: 18; (21)Complexity: 268; (22)Covalently-Bonded Unit Count: 1; (23)Feature 3D Acceptor Count: 3; (24)Feature 3D Ring Count: 3.

What's more, the following datas could be converted into the molecular structure:
(1)Canonical SMILES: C1=CC=C2C(=C1)C(=NN=C2Cl)CC3=CC=NC=C3
(2)InChI: InChI=1S/C14H10ClN3/c15-14-12-4-2-1-3-11(12)13(17-18-14)9-10-5-7-16-8-6-10/h1-8H,9H2
(3)InChIKey: LVSFOJFCLFTXTO-UHFFFAOYSA-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 101094-85-3