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Nonyl acetate

CAS 143-13-5C11H22O2MW 186.16 g/mol

Nonyl acetate (CAS 143-13-5) — formula C11H22O2, molecular weight 186.16 g/mol.

Specifications

CAS Number143-13-5
Molecular FormulaC11H22O2
Molecular Weight186.16 g/mol
Melting Point-26 °C
Boiling Point406.4 to 413.6 °F at 760 mmHg (USCG, 1999)
LogP4

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What this product is

Nonyl acetate is a chemical compound with CAS registry number 143-13-5 and molecular formula C11H22O2 (molecular weight 186.16 g/mol).

Identification

CAS number: 143-13-5

Its molecular formula C11H22O2 comprises 11 C, 22 H, 2 O atoms.

Also known as: Nonyl acetate · Acetic Acid n-Nonyl Ester

Frequently Asked Questions

What is the CAS number of Nonyl acetate?

The CAS registry number of Nonyl acetate is 143-13-5.

What is the molecular formula and molecular weight of Nonyl acetate?

Molecular formula C11H22O2, molecular weight 186.16 g/mol.

What other names is Nonyl acetate known by?

It is also registered under: Nonyl acetate, Acetic Acid n-Nonyl Ester.

PubChem Public Data

Public-database records for Nonyl acetate (CAS 143-13-5), reproduced here for independent cross-checking.

Safety classification and hazard statements

GHS notification summary16.9% (263 / 1555)
Reported hazard statementsH411 (83.1%)

This chemical does not meet GHS hazard criteria for 16.9% (263 of 1555) of reports.

H411 (83.1%): Toxic to aquatic life with long lasting effects [Hazardous to the aquatic environment, long-term hazard]

Regulatory listings

Regulatory & Food ContactEU Flavoring substances
FDA Substance added to food: 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 summary16.9% (263 / 1555)

Physical description and handling notes

  • Nonyl acetate is a colorless liquid with a pungent odor of mushrooms. Less dense than water and insoluble in water. Hence floats on water. (USCG, 1999)
  • Liquid
  • colourless liquid with a floral, fruity odour
  • soluble in alcohol, ether; insoluble in water
  • 1 ml in 6 ml 70% alcohol (in ethanol)
  • 0.8785 at 59 °F (USCG, 1999) - Less dense than water; will float

Reported physical properties

沸点406.4 to 413.6 °F at 760 mmHg (USCG, 1999)
沸点212.00 °C. @ 760.00 mm Hg
沸点208-212 °C
熔点-26 °C
密度0.864-0.868
折射率1.422-1.426

How this substance is indexed

CAS Registry Number143-13-5
PubChem CID8918
分子式C11H22O2
分子量186.16 g/mol
IUPAC 名称nonyl acetate
InChIKeyGJQIMXVRFNLMTB-UHFFFAOYSA-N
UNII(FDA)M2SE618B1L
ChEBI 编号CHEBI:87511
FEMA 编号2788
JECFA 编号131

Documented uses

  • Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes
  • Flavoring Agents -> JECFA Flavorings Index
  • Acetic acid, nonyl ester: ACTIVE

Names this substance appears under

NONYL ACETATE; Acetic acid, nonyl ester; Acetic Acid Nonyl Ester; NONYLACETATE; DTXSID4047123; EINECS 205-585-8; UNII-M2SE618B1L; NSC 82356; M2SE618B1L; AI3-11583; NSC-82356; NONYL ACETATE [FCC]; NONYL ACETATE [FHFI]; DTXCID2027123; CHEBI:87511; FEMA 2788

Computed molecular descriptors

分子量186.29
XLogP34
氢键供体数0
氢键受体数2
可旋转键数9
精确质量186.161979940
单同位素质量186.161979940
拓扑极性表面积26.3
重原子数13
形式电荷0

Database abstract

Nonyl acetate is identified by CAS 143-13-5, molecular formula C11H22O2 and molecular weight 186.16 g/mol. UNII M2SE618B1L; ChEBI 87511; InChIKey GJQIMXVRFNLMTB-UHFFFAOYSA-N. 沸点: 406.4 to 413.6 °F at 760 mmHg (USCG, 1999); 沸点: 212.00 °C. @ 760.00 mm Hg; 沸点: 208-212 °C.

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

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