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

Benzaldehyde,3-(1H-pyrazol-3-yl)-

Related Products

Hot Products

Name

Benzaldehyde,3-(1H-pyrazol-3-yl)-

EINECS N/A
CAS No. 179057-26-2 Density 1.248 g/cm3
PSA 45.75000 LogP 1.88920
Solubility N/A Melting Point N/A
Formula C10H8N2O Boiling Point 420.424 °C at 760 mmHg
Molecular Weight 172.18332 Flash Point 209.555 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 179057-26-2 (3-(1H-PYRAZOL-3-YL)BENZALDEHYDE) Hazard Symbols N/A
Synonyms

3-(1H-Pyrazol-3-yl)benzaldehyde;3-(3-Pyrazolyl)benzaldehyde;

Article Data 2

Benzaldehyde,3-(1H-pyrazol-3-yl)- Specification

The CAS registry number of Benzaldehyde,3-(1H-pyrazol-3-yl)- is 179057-26-2. This chemical's molecular formula is C10H8N2O and molecular weight is 172.18332. What's more, its systematic name is called 3-(1H-Pyrazol-5-yl)benzaldehyde.

Physical properties about Benzaldehyde,3-(1H-pyrazol-3-yl)- are: (1)ACD/LogP: 1.88; (2)#of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2; (4)ACD/LogD (pH 7.4): 2; (5)ACD/BCF (pH 5.5): 13; (6)ACD/BCF (pH 7.4): 13; (7)ACD/KOC (pH 5.5): 220; (8)ACD/KOC (pH 7.4): 220; (9)#H bond acceptors: 3; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 45.75 Å2; (13)Index of Refraction: 1.647; (14)Molar Refractivity: 50.122 cm3; (15)Molar Volume: 137.93 cm3; (16)Polarizability: 19.87×10-24 cm3; (17)Surface Tension: 57.272 dyne/cm; (18)Density: 1.248 g/cm3; (19)Flash Point: 209.555 °C; (20)Enthalpy of Vaporization: 67.428 kJ/mol; (21)Boiling Point: 420.424 °C at 760 mmHg; (22)Vapour Pressure: 0 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: O=Cc1cccc(c1)c2ccnn2
(2) InChI: InChI=1/C10H8N2O/c13-7-8-2-1-3-9(6-8)10-4-5-11-12-10/h1-7H,(H,11,12)
(3) InChIKey: DGRNDHQFGQBXSM-UHFFFAOYAB

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 179057-26-2