2,4-Hexadien-1-ol

Name: 2,4-Hexadien-1-ol
Brand: Jinan Shenghe Chemical Co., Ltd.
SKU: 160374

CAS 111-28-4C6H10OMW 98.14 g/mol

2,4-Hexadien-1-ol (CAS 111-28-4) — formula C6H10O, molecular weight 98.14 g/mol.

Specifications

CAS Number111-28-4

Molecular FormulaC6H10O

Molecular Weight98.14 g/mol

LogP1.1

ApplicationsUsed as a reagent in organic chemistry, Used as a flavoring agent

Where it is used

Documented applications: Used as a reagent in organic chemistry, Used as a flavoring agent.

Purchase Profile

What this product is

2,4-Hexadien-1-ol is a chemical compound with CAS registry number 111-28-4 and molecular formula C6H10O (molecular weight 98.14 g/mol).

Identification

CAS number: 111-28-4

Its molecular formula C6H10O comprises 6 C, 10 H, 1 O atoms.

Also known as: 2,4-Hexadien-1-ol · Sorbyl alcohol

Frequently Asked Questions

What is the CAS number of 2,4-Hexadien-1-ol?

The CAS registry number of 2,4-Hexadien-1-ol is 111-28-4.

What is the molecular formula and molecular weight of 2,4-Hexadien-1-ol?

Molecular formula C6H10O, molecular weight 98.14 g/mol.

What other names is 2,4-Hexadien-1-ol known by?

It is also registered under: 2,4-Hexadien-1-ol, Sorbyl alcohol.

What are the documented applications of 2,4-Hexadien-1-ol?

Recorded applications: Used as a reagent in organic chemistry, Used as a flavoring agent.

PubChem Public Data

Public-database records for 2,4-Hexadien-1-ol (CAS 111-28-4), reproduced here for independent cross-checking.

Safety classification and hazard statements

Reported hazard statements	H302 (99.2%), H311 (99.6%), H315 (100%), H319 (99.6%)

H302 (99.2%): Harmful if swallowed [Warning Acute toxicity, oral]

H311 (99.6%): Toxic in contact with skin [Danger Acute toxicity, dermal]

Regulatory listings

Regulatory & Food Contact	EU Flavoring substances FDA Substance added to food: FLAVORING AGENT OR ADJUVANT Flavoring Agents Fruit

Physical description and handling notes

Solid with an agreeable odor of freshly cut grass; mp = 30.5-31.5 deg C; [Merck Index] Colorless solid with a green herbal odor; [Bedoukian Research MSDS]
colourless solid; green, vegetable aroma
Insoluble in water; Soluble in fat
soluble (in ethanol)

Reported physical properties

蒸气压	0.02 [mmHg]

How this substance is indexed

CAS Registry Number	111-28-4
PubChem CID	8104
分子式	C6H10O
分子量	98.14 g/mol
IUPAC 名称	hexa-2,4-dien-1-ol
InChIKey	MEIRRNXMZYDVDW-UHFFFAOYSA-N
UNII（FDA）	NS00079202
FEMA 编号	3922
JECFA 编号	1174

Documented uses

Used as a reagent in organic chemistry; [Merck Index] Used as a flavoring agent; [FDA]
Flavoring Agents -> JECFA Flavorings Index
1-Hydroxy-2,4-hexadiene; Hexa-2,4-dien-1-ol; Sorbic alcohol; Sorbyl alcohol; Hexadienol (commercial name)
IFRA 51st Amendment - Guidance for the use of IFRA Standards
Prohibition: This material should not be used as a fragrance ingredient
This material should not be used as a fragrance ingredient.

Names this substance appears under

hexa-2,4-dien-1-ol; DTXSID8047632; RefChem:785768; DTXCID6027632; 111-28-4; 2,4-Hexadien-1-OL; Sorbyl alcohol; hexa-2,4-diene-1-ol; 2,a4-aHexadien-a1-aol; SCHEMBL21952; E,E-2,4-Hexadien-1-ol; SCHEMBL1616298; SCHEMBL3867059; SCHEMBL28549828; DB-019214; NS00079202

Computed molecular descriptors

分子量	98.14
XLogP3	1.1
氢键供体数	1
氢键受体数	1
可旋转键数	2
精确质量	98.073164938
单同位素质量	98.073164938
拓扑极性表面积	20.2
重原子数	7
形式电荷	0

Database abstract

2,4-Hexadien-1-ol is identified by CAS 111-28-4, molecular formula C6H10O and molecular weight 98.14 g/mol. UNII NS00079202; InChIKey MEIRRNXMZYDVDW-UHFFFAOYSA-N. 蒸气压: 0.02 [mmHg].

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

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