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neryl isovalerate

CAS 3915-83-1C15H26O2MW 238.37

neryl isovalerate (CAS 3915-83-1) — formula C15H26O2, molecular weight 238.37; category organic chemicals.

Product Overview

CAS Number3915-83-1
Molecular FormulaC15H26O2
Molecular Weight238.37
Boiling Point145.00 °C. @ 15.00 mm Hg
LogP4.7
CategoryOrganic Chemicals

Technical Profile

What this product is

neryl isovalerate is a carbon-based organic compound with CAS registry number 3915-83-1 and molecular formula C15H26O2 (molecular weight 238.37), belonging to the organic chemicals segment of chemical raw materials.

Identification

CAS number: 3915-83-1

Its molecular formula C15H26O2 comprises 15 C, 26 H, 2 O atoms.

Also known as: neryl isovalerate · 异戊酸橙花酯

Category: organic chemicals

Frequently Asked Questions

What is the CAS number of neryl isovalerate?

The CAS registry number of neryl isovalerate is 3915-83-1.

What is the molecular formula and molecular weight of neryl isovalerate?

Molecular formula C15H26O2, molecular weight 238.37.

What other names is neryl isovalerate known by?

It is also registered under: neryl isovalerate, 异戊酸橙花酯.

Which category does neryl isovalerate belong to?

Category: Organic Chemicals.

PubChem Public Data

Independent reference data for neryl isovalerate (CAS 3915-83-1), compiled from public chemistry databases.

Registry identifiers across databases

CAS Registry Number3915-83-1
PubChem CID6429039
Molecular formulaC15H26O2
IUPAC name[(2Z)-3,7-dimethylocta-2,6-dienyl] 3-methylbutanoate
UNII (FDA)5RC970J93J
FEMA number2778
JECFA number76

Computed descriptors

Molecular Weight238.37
XLogP34.7
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count8
Exact Mass238.193280068
Monoisotopic Mass238.193280068
Topological Polar Surface Area26.3
Heavy Atom Count17

Physicochemical values on record

Boiling Point145.00 °C. @ 15.00 mm Hg
Boiling Point238 °C
Density0.889-0.893
Refractive Index1.4531-1.460

Documented uses on record

    Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional ClassesFlavoring Agents -> JECFA Flavorings Index

    Synonyms and trade names

    Neryl isovalerate; 3915-83-1; Neryl isovalerianate; Nerol isovalerate; Neryl 3-methylbutanoate; Neryl 3-methylbutyrate; FEMA No. 2778; (Z)-Geranyl isovalerate; Neryl beta-methylbutyrate; Isovaleric acid neryl ester; [(2Z)-3,7-dimethylocta-2,6-dienyl] 3-methylbutanoate; UNII-5RC970J93J; 5RC970J93J; EINECS 223-478-4; Neryl .beta.-methyl butyrate; NERYL ISOVALERATE [FHFI]

    Regulatory listings held on file

    Regulatory & Food ContactEU 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 summary2.5% (1 / 40)

    GHS hazard classification

    GHS notification summary2.5% (1 / 40)
    Reported hazard statementsH315 (97.5%), H319 (97.5%), H335 (97.5%)

    This chemical does not meet GHS hazard criteria for 2.5% (1 of 40) of reports.

    H315 (97.5%): Causes skin irritation [Warning Skin corrosion/irritation]

    What the public record says

    neryl isovalerate · CAS 3915-83-1 · C15H26O2. UNII 5RC970J93J. Boiling Point: 145.00 °C. @ 15.00 mm Hg; Boiling Point: 238 °C; Density: 0.889-0.893.

    Physical description and handling notes

    Source: PubChem / Wikidata; the batch COA governs where values differ.

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