NERYL PROPIONATE

Description

NERYL PROPIONATE is identified by CAS 105-91-9, molecular formula C13H22O2 and molecular weight 210.16 g/mol. UNII FAS39QE02Z; ChEBI 174072; InChIKey BYCHQEILESTMQU-XFXZXTDPSA-N. Boiling Point: 233.00 °C. @ 760.00 mm Hg; Boiling Point: 233 °C; Density: 0.89-0.91 (d20/4).

Identification

CAS Registry Number	105-91-9
PubChem CID	5365982
Molecular formula	C13H22O2
Molecular weight	210.16 g/mol
IUPAC name	[(2Z)-3,7-dimethylocta-2,6-dienyl] propanoate
InChIKey	BYCHQEILESTMQU-XFXZXTDPSA-N
UNII (FDA)	FAS39QE02Z
ChEBI ID	CHEBI:174072
FEMA number	2777
JECFA number	63

Computed Descriptors

Molecular Weight	210.31
XLogP3	3.9
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	7
Exact Mass	210.161979940
Monoisotopic Mass	210.161979940
Topological Polar Surface Area	26.3
Heavy Atom Count	15
Formal Charge	0

Physical & Chemical Properties

Boiling Point	233.00 °C. @ 760.00 mm Hg
Boiling Point	233 °C
Density	0.89-0.91 (d20/4)
Refractive Index	1.45-1.47

Physical description & handling notes

• colourless, oily liquid/ether, fruity, jasmine, rose odour
• very slightly
• very slightly soluble in water; soluble in alcohol
• 1 ml in 15 ml 70% alcohol (in ethanol)

Regulatory Status

Regulatory & Food Contact	EU Flavoring substances FDA Substance added to food: FLAVOR ENHANCER, FLAVORING AGENT OR ADJUVANT Flavoring Agents FLAVOURING_AGENT: Flavouring Agent Fruit No safety concern at current levels of intake when used as a flavouring agent
GHS notification summary	100% (90 / 90)

GHS Hazard Classification

GHS notification summary	100% (90 / 90)

Documented Uses

• Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes
• Flavoring Agents -> JECFA Flavorings Index
• 2,6-Octadien-1-ol, 3,7-dimethyl-, 1-propanoate, (2Z)-: ACTIVE

Synonyms

Neryl propionate; Neryl propanoate; 105-91-9; Propionic acid, neryl ester; FEMA No. 2777; Neryl propionate (natural); [(2Z)-3,7-dimethylocta-2,6-dienyl] propanoate; cis-3,7-Dimethyl-2,6-octadien-1-ol, propionate; UNII-FAS39QE02Z; 2,6-OCTADIEN-1-OL, 3,7-DIMETHYL-, PROPIONATE, (Z)-; EINECS 203-345-7; FAS39QE02Z; Propionic acid, 3,7-dimethyl-2,6-octadien-1-yl ester; 2,6-Octadien-1-ol, 3,7-dimethyl-, propanoate, (Z)-; (2Z)-3,7-dimethylocta-2,6-dien-1-yl propanoate; 3,7-Dimethyl-2,6-octadienyl propanoate, (Z)-

Frequently Asked Questions

What are the CAS number and molecular formula of NERYL PROPIONATE?

CAS 105-91-9; molecular formula C13H22O2; molecular weight 210.16 g/mol.

What other names is NERYL PROPIONATE known by?

Neryl propionate, Neryl propanoate, 105-91-9, Propionic acid, neryl ester, FEMA No. 2777, Neryl propionate (natural).

What is the regulatory status of NERYL PROPIONATE?

Documented regulatory listings: EU Flavoring substances; FDA Substance added to food: FLAVOR ENHANCER, FLAVORING AGENT OR ADJUVANT; Flavoring Agents.

Is NERYL PROPIONATE classified as hazardous?

100% of GHS notifications report no hazard classification (90 of 90).

What are the key physical properties of NERYL PROPIONATE?

Boiling Point: 233.00 °C. @ 760.00 mm Hg; Boiling Point: 233 °C; Density: 0.89-0.91 (d20/4); Refractive Index: 1.45-1.47.

Facts on this page are taken from PubChem (US National Library of Medicine) and Wikidata. Grade-specific data — assay, moisture, particle size, packaging, shelf life — is issued per batch on the COA and is not published here.