Ambroxide information

Ambroxide
Names
	Preferred IUPAC name (3aR,5aS,9aS,9bR)-3a,6,6,9a-Tetramethyldodecahydronaphtho[2,1-b]furan
	Other names Ambrox (Firmenich); Ambrofix (Givaudan); Ambroxan (Kao); Ambermox; Orcanox; (3aR-(3aα,5aβ,9aα,9bβ))-Dodecahydro-3a,6,6,9a-tetra-methylnaphtho(2,1-b)furan;; Naphtho(2,1-b)furan, dodecahydro-3a,6,6,9a-tetramethyl-,;; 8α, 12-Oxido-13,14,15,16-tetranorlabdane;; 1,5,5,9-Tetramethyl-13-oxatricyclo(8.3.0.0(4,9))tridecane
Identifiers
CAS Number	100679-85-4 ; 3738-00-9 (unspecified stereochemistry) ;
3D model (JSmol)	Interactive image;
ChEBI	CHEBI:78307;
ChEMBL	ChEMBL496447 ;
ChemSpider	9032756 ;
ECHA InfoCard	100.027.147
EC Number	229-861-2;
PubChem CID	10857465;
UNII	K60YJF1E9A ;
CompTox Dashboard (EPA)	DTXSID0047113 ;
	InChI InChI=1S/C16H28O/c1-14(2)8-5-9-15(3)12(14)6-10-16(4)13(15)7-11-17-16/h12-13H,5-11H2,1-4H3/t12-,13+,15-,16+/m0/s1 Key: YPZUZOLGGMJZJO-LQKXBSAEBI ; InChI=1S/C16H28O/c1-14(2)8-5-9-15(3)12(14)6-10-16(4)13(15)7-11-17-16/h12-13H,5-11H2,1-4H3/t12-,13+,15-,16+/m0/s1;
	SMILES CC1(CCC[C@]2([C@H]1CC[C@@]3([C@@H]2CCO3)C)C)C;
Properties
Chemical formula	C16H28O
Molar mass	236.399 g·mol−1
Density	0.939 g/cm3
Melting point	75 °C (167 °F; 348 K)
Boiling point	120 °C (248 °F; 393 K) (1.40 mm Hg)
Solubility in water	insoluble
Solubility in ethanol	soluble
Refractive index (nD)	1.48
Hazards
Flash point	161 °C (322 °F; 434 K)
	Except where otherwise noted, data are given for materials in their standard state (at 25 °C [77 °F], 100 kPa). (what is ?) Infobox references

Ambroxide, widely known by the brand name Ambroxan, is a naturally occurring terpenoid and one of the key constituents responsible for the odor of ambergris. It is an autoxidation product of ambrein.^[2] Ambroxide is used in perfumery for creating ambergris notes and as a fixative.^[2] Small amounts (< 0.01 ppm) are used as a flavoring in food.^[3]

^ "Apply for a Trademark. Search a Trademark". trademarkia.com. Retrieved 25 February 2018.
^ ^a ^b Karl-Georg Fahlbusch; et al. (2007), "Flavors and Fragrances", Ullmann's Encyclopedia of Industrial Chemistry (7th ed.), Wiley, p. 72
^ George A. Burdock (2010), "1,5,5,9-TETRAMETHYL-13-OXATRICYCLO-(8.3.0.0(4,9)) TRIDECANE", Fenaroli's Handbook of Flavor Ingredients (6th ed.), CRC Press, p. 1895

[1] "Apply for a Trademark. Search a Trademark". trademarkia.com. Retrieved 25 February 2018.

[perf-2] Karl-Georg Fahlbusch; et al. (2007), "Flavors and Fragrances", Ullmann's Encyclopedia of Industrial Chemistry (7th ed.), Wiley, p. 72

[3] George A. Burdock (2010), "1,5,5,9-TETRAMETHYL-13-OXATRICYCLO-(8.3.0.0(4,9)) TRIDECANE", Fenaroli's Handbook of Flavor Ingredients (6th ed.), CRC Press, p. 1895

Ambroxide information

and 4 Related for: Ambroxide information

Ambroxide

Ambergris

Synthetic musk

C16H28O

Names

Preferred IUPAC name (3aR,5aS,9aS,9bR)-3a,6,6,9a-Tetramethyldodecahydronaphtho[2,1-b]furan
Other names Ambrox (Firmenich) Ambrofix (Givaudan) Ambroxan (Kao)^[1] Ambermox Orcanox (3aR-(3aα,5aβ,9aα,9bβ))-Dodecahydro-3a,6,6,9a-tetra-methylnaphtho(2,1-b)furan; Naphtho(2,1-b)furan, dodecahydro-3a,6,6,9a-tetramethyl-,; 8α, 12-Oxido-13,14,15,16-tetranorlabdane; 1,5,5,9-Tetramethyl-13-oxatricyclo(8.3.0.0(4,9))tridecane
Identifiers
CAS Number	100679-85-4^Y 3738-00-9 (unspecified stereochemistry)^Y
3D model (JSmol)	Interactive image
ChEBI	CHEBI:78307
ChEMBL	ChEMBL496447^Y
ChemSpider	9032756^Y
ECHA InfoCard	100.027.147
EC Number	229-861-2
PubChem CID	10857465
UNII	K60YJF1E9A^Y
CompTox Dashboard (EPA)	DTXSID0047113
InChI InChI=1S/C16H28O/c1-14(2)8-5-9-15(3)12(14)6-10-16(4)13(15)7-11-17-16/h12-13H,5-11H2,1-4H3/t12-,13+,15-,16+/m0/s1^Y Key: YPZUZOLGGMJZJO-LQKXBSAEBI^N InChI=1S/C16H28O/c1-14(2)8-5-9-15(3)12(14)6-10-16(4)13(15)7-11-17-16/h12-13H,5-11H2,1-4H3/t12-,13+,15-,16+/m0/s1
SMILES CC1(CCC[C@]2([C@H]1CC[C@@]3([C@@H]2CCO3)C)C)C
Properties
Chemical formula	C₁₆H₂₈O
Molar mass	236.399 g·mol⁻¹
Density	0.939 g/cm³
Melting point	75 °C (167 °F; 348 K)
Boiling point	120 °C (248 °F; 393 K) (1.40 mm Hg)
Solubility in water	insoluble
Solubility in ethanol	soluble
Refractive index (n_D)	1.48
Hazards
Flash point	161 °C (322 °F; 434 K)
Except where otherwise noted, data are given for materials in their standard state (at 25 °C [77 °F], 100 kPa). N (what is ^YN ?) Infobox references