CITRONELLYL BUTYRATE

Catalog No: FT-0623968

CAS No: 141-16-2

Chemical Name: CITRONELLYL BUTYRATE
Molecular Formula: C14H26O2
Molecular Weight: 226.35
InChI Key: XQPZQXTWYZAXAK-UHFFFAOYSA-N
InChI: InChI=1S/C14H26O2/c1-5-7-14(15)16-11-10-13(4)9-6-8-12(2)3/h8,13H,5-7,9-11H2,1-4H3

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

Refractive_Index:	n20/D 1.445(lit.)
Vapor_Pressure:	0.00161mmHg at 25°C
Flash_Point:	>230 °F
LogP:	4.10230
Bolling_Point:	245 °C(lit.)
FW:	226.35500
PSA:	26.30000
Computational_Chemistry:	['1. XlogP :46 ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :2 ', '4. Rotatable Bond Count :9 ', '5. Isotope Atom Count :N/A ', '6. TPSA 263 ', '7. Heavy Atom Count :16 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :215 ', '10. Isotope Atom Count :0 ', '11. Defined Atom Stereocenter Count :0 ', '12. Undefined Atom Stereocenter Count :1 ', '13. Defined Bond Stereocenter Count :0 ', '14. Undefined Bond Stereocenter Count :0 ', '15. Covalently-Bonded Unit Count :1']
MF:	C14H26O2
Exact_Mass:	226.19300
Molecular_Structure:	['1 . Molar refractive index 6854 ', '2 . Molar volume 2569 ', '3 . Parachor （902K）5946 ', '4 . Surface tension 287 ', '5 . Polarizability 2717']
Density:	0.873 g/mL at 25 °C(lit.)
More_Info:	['1外观与. Appearance Colourless Liquid ，呈甚强烈玫瑰香气，带有苹果香味。天然品存在于锡兰香茅油中。 ', '2. Boiling point（℃）245。 ', '3. Flash point（℃）>100。 ', "4旋光度±1°30'。 ", '5. Solubility 混Soluble in Ethanol Ethyl ether 氯仿and 大多数非挥发性油，几Insoluble in Water 。']

Symbol:	GHS07
Risk_Statements(EU):	R36/37/38
WGK_Germany:	2
RTECS:	RH3430000
RIDADR:	NONH for all modes of transport
Hazard_Codes:	Xi: Irritant;
Warning_Statement:	P261-P305 + P351 + P338
Safety_Statements:	H315-H319-H335