4-(Hydroxyphenyl)-1-heptanone

Catalog No: FT-0634381

CAS No: 2589-72-2

Chemical Name: 4-(Hydroxyphenyl)-1-heptanone
Molecular Formula: C12H16O2
Molecular Weight: 192.25 g/mol
InChI Key: YDGNMJZDWLQUTE-UHFFFAOYSA-N
InChI: InChI=1S/C12H16O2/c1-2-3-4-5-12(14)10-6-8-11(13)9-7-10/h6-9,13H,2-5H2,1H3

Product pricing and availability information
Assay	Pack Size	Price	Stock
98%	1g	N/A	N/A
98%	5g	N/A	N/A
98%	Bulk Quantity	N/A	N/A

Bolling_Point:	167 °C / 1mmHg
MF:	C12H16O2
Density:	1.036g/cm3
FW:	192.25400
Product_Name:	4-(Hydroxyphenyl)-1-heptanone
CAS:	2589-72-2
Flash_Point:	143.8ºC
Melting_Point:	63 °C

Bolling_Point:	167 °C / 1mmHg
Vapor_Pressure:	5.19E-05mmHg at 25°C
LogP:	3.15520
More_Info:	['1 . Appearance 无可用 ', '2 . Density（g/mL,25/4℃）无可用 ', '3 . Relative vapor density（g/mL,Atmosphere =1）无可用 ', '4 . Melting point（ºC）63 ', '5 . Boiling point（ºC,Atmospheric pressure）167 ', '6 . Boiling point（ºC,52kPa）无可用 ', '7 . Refractive index无可用 ', '8 . Flash point（ºC）无可用 ', '9 . Specific rotation（º）无可用 ', '10 . Spontaneous ignition point or ignition temperature（ºC）无可用 ', '11 . Vapor pressure（kPa,25ºC）无可用 ', '12 . Saturated vapor pressure（kPa,60ºC）无可用 ', '13 . Combustion heat（KJ/mol）无可用 ', '14 . Critical temperature（ºC）无可用 ', '15 . Critical pressure（KPa）无可用 ', '16 . Oil-water（Octanol /Water ）Logarithmic Value of Distribution Coefficient 无可用 ', '17 . Upper limit of explosion（%,V/V）无可用 ', '18 . Lower limit of explosion（%,V/V）无可用 ', '19 . Solubility 无可用']
Computational_Chemistry:	['1. XlogP :32 ', '2. Hydrogen Bond Donor Count :1 ', '3. Hydrogen Bond Acceptor Count :2 ', '4. Rotatable Bond Count :5 ', '5. Isotope Atom Count :7 ', '6. TPSA 373 ', '7. Heavy Atom Count :14 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :169 ', '10. Isotope Atom Count :0 ', '11. Defined Atom Stereocenter Count :0 ', '12. Undefined Atom Stereocenter Count :0 ', '13. Defined Bond Stereocenter Count :0 ', '14. Undefined Bond Stereocenter Count :0 ', '15. Covalently-Bonded Unit Count :1']
Melting_Point:	63 °C
Exact_Mass:	192.11500
MF:	C12H16O2
Density:	1.036g/cm3
Refractive_Index:	1.523
PSA:	37.30000
Flash_Point:	143.8ºC
Molecular_Structure:	['1 . Molar refractive index 5669 ', '2 . Molar volume （m3/mol）1854 ', '3 . Parachor （902K）4666 ', '4 . Surface tension 401 ', '5 . Polarizability 2247']
FW:	192.25400

Safety_Statements:	S26-S36
WGK_Germany:	1
Hazard_Codes:	Xn
RTECS:	DU2800000
HS_Code:	2914501900
Risk_Statements(EU):	R22:Harmful if swallowed. R36/37/38:Irritating to eyes, respiratory system and skin . R41:Risk of serious damage to eyes.