Antibiotic757 (9CI) supplier

Name
4-(1,2,6-trimethylpyridin-4-ylidene)cyclohexa-2,5-dien-1-one
EINECS
CAS No. 6297-29-6
Density 1.107g/cm³
Solubility
Melting Point
Formula C₁₄H₁₅NO
Boiling Point 328 °C at 760 mmHg
Molecular Weight 213.275
Flash Point 119.7 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 4-(1,2,6-trimethylpyridin-4-ylidene)cyclohexa-2,5-dien-1-one
PSA 22.00000
LogP 1.76880

Antibiotic757 (9CI) Specification

The Antibiotic757 (9CI), with CAS registry number 6297-29-6, has the systematic name of 4-(1,2,6-trimethylpyridin-4(1H)-ylidene)cyclohexa-2,5-dien-1-one. And the chemical formula of this chemical is C₁₄H₁₅NO.

Physical properties of Antibiotic757 (9CI): (1)ACD/LogP: 0.39; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 2; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 0; (6)Polar Surface Area: 20.31 Å²; (7)Index of Refraction: 1.585; (8)Molar Refractivity: 64.59 cm³; (9)Molar Volume: 192.5 cm³; (10)Polarizability: 25.6×10^-24cm³; (11)Surface Tension: 40.7 dyne/cm; (12)Density: 1.107 g/cm³; (13)Flash Point: 119.7 °C; (14)Enthalpy of Vaporization: 57.03 kJ/mol; (15)Boiling Point: 328 °C at 760 mmHg; (16)Vapour Pressure: 0.000195 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C\2/C=C\C(=C\1/C=C(\N(/C(=C/1)C)C)C)/C=C/2
(2)InChI: InChI=1/C14H15NO/c1-10-8-13(9-11(2)15(10)3)12-4-6-14(16)7-5-12/h4-9H,1-3H3
(3)InChIKey: LDSXDRWWZDIPOT-UHFFFAOYAG
(4)Std. InChI: InChI=1S/C14H15NO/c1-10-8-13(9-11(2)15(10)3)12-4-6-14(16)7-5-12/h4-9H,1-3H3
(5)Std. InChIKey: LDSXDRWWZDIPOT-UHFFFAOYSA-N

Product Name

4-(1,2,6-trimethylpyridin-4-ylidene)cyclohexa-2,5-dien-1-one

Antibiotic757 (9CI) Specification

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