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3-HEPTANOL

3-HEPTANOL structure

CAS No.: 589-82-2

Chemical Name:: 3-HEPTANOL

Synonyms: FEMA 3547;3-HEPTANOL;ALCOHOL C7;Heptanol-3;heptan-3-ol;DL-3-HEPTANOL;n-Heptan-3-ol;3-Heptanol>3-HEPTANOL 97%;3-Heptanol,99%

CBNumber:: CB1200328

Molecular Formula:: C7H16O

Molecular Weight:: 116.2

MDL Number:: MFCD00004586

MOL File:: 589-82-2.mol

MSDS File:: SDS

Last updated:2024-03-26 14:13:49

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3-HEPTANOL Properties

Melting point	-70°C
Boiling point	66 °C/20 mmHg (lit.)
Density	0.821 g/mL at 20 °C 0.818 g/mL at 25 °C (lit.)
FEMA	3547 \| 3-HEPTANOL
refractive index	n20/D 1.421(lit.)
Flash point	130 °F
storage temp.	2-8°C
solubility	Chloroform, Methanol (Sparingly)
pka	15.31±0.20(Predicted)
color	Colorless to Almost colorless
Odor	at 1.00 % in dipropylene glycol. powerful herbal
Odor Type	herbal
Water Solubility	3.984g/L(25 ºC)
JECFA Number	286
BRN	1719067
Dielectric constant	6.8600000000000003
LogP	2.29
CAS DataBase Reference	589-82-2(CAS DataBase Reference)
Substances Added to Food (formerly EAFUS)	3-HEPTANOL
FDA 21 CFR	172.515
EWG's Food Scores	1
FDA UNII	12YBT48HMK
EPA Substance Registry System	3-Heptanol (589-82-2)

SAFETY

Risk and Safety Statements

Symbol(GHS)

GHS02,GHS07

Signal word

Warning

Hazard statements

H226-H302

Precautionary statements

P210-P301+P312+P330

Hazard Codes

Risk Statements

Safety Statements

23-24/25

RIDADR

UN 1987 3/PG 3

WGK Germany

RTECS

MJ3150000

HS Code

2905.19.9090

HazardClass

PackingGroup

III

Toxicity

The acute oral LD₅₀ was reported as 4.3 g/kg and 6 g/kg in mice and as 3.25 g/kg in rats . The acute dermal LD₅₀ in rabbits was reported as > 5 g/kg . The acute inhalation LC 50 in mice was reported as 6.6 mg/litre

NFPA 704

	2
0		0

3-HEPTANOL price More Price(8)

Manufacturer	Product number	Product description	CAS number	Packaging	Price	Updated	Buy
Sigma-Aldrich	109363	3-Heptanol 99%	589-82-2	25ml	$71.4	2024-03-01	Buy
TCI Chemical	H0035	3-Heptanol >98.0%(GC)	589-82-2	25mL	$59	2024-03-01	Buy
TCI Chemical	H0035	3-Heptanol >98.0%(GC)	589-82-2	500mL	$613	2024-03-01	Buy
TRC	H281210	(±)-3-Heptanol	589-82-2	10g	$195	2021-12-16	Buy
AK Scientific	8762AB	Heptan-3-ol	589-82-2	25ml	$136	2021-12-16	Buy

Product number	Packaging	Price	Buy
109363	25ml	$71.4	Buy
H0035	25mL	$59	Buy
H0035	500mL	$613	Buy
H281210	10g	$195	Buy
8762AB	25ml	$136	Buy

3-HEPTANOL Chemical Properties,Uses,Production

Description

3-Heptanol has a powerful, herbaceous odor and a pungent, slightly bitter taste. May be prepared through catalytic hydrogenation of ethyl-n-butyl ketone.

Chemical Properties

Colorless, oily liquid

Chemical Properties

3-Heptanol has a powerful, herbaceous odor and a pungent, slightly bitter taste.

Occurrence

Reported found in banana, papaya, French fried potato, peppermint oil, butter, fried or grilled beef, cognac, coffee, peated malt and rooibus tea (Aspalathius linearis)

Uses

Flotation frother, solvent and diluent in organic coatings, intermediates.

Uses

3-Heptanol can be used:

As a solvent to form microenvironments around single-walled carbon nanotubes.
To prepare substituted pyrimidine derivatives as C1 domain-targeted isophthalate analogs to study their binding affinities towards PKCα?isoform.
As a building block to synthesize 4-(3-adamantan-1-yl-ureido)-butyric acid and cyclohexanecarboxylic acid derivatives as sEH inhibitors.

Definition

ChEBI: Heptan-3-ol is a secondary alcohol.

Preparation

By catalytic hydrogenation of ethyl-n-butyl ketone.

Aroma threshold values

240 to 410 ppb.

Synthesis Reference(s)

The Journal of Organic Chemistry, 30, p. 3760, 1965 DOI: 10.1021/jo01022a038
Synthetic Communications, 26, p. 1065, 1996 DOI: 10.1080/00397919608003713

General Description

3-Heptanol is the main biotransformation product of n-heptane.

Hazard

Toxic by ingestion. Moderate fire risk.

Biochem/physiol Actions

Odor at 1.0%

Metabolism

In the rabbit, heptan-l-ol is metabolized partly by direct conjugation with glucuronic acid to form an ether glucuronide and mainly by oxidation to the carboxylic acid, which either undergoes further oxidation to CO₂ or forms an ester glucuronide

3-HEPTANOL synthesis

Synthesis of 3-HEPTANOL from 3-Heptanone

3-HEPTANOL Preparation Products And Raw materials

Raw materials

3-Heptanone 1-HEPTEN-3-OL 2-Ethylhexanoic acid 2-ETHYLHEXANAL 3-Heptanol, 3-formate

4-HEPTANOL Isopropyl alcohol Heptane

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Preparation Products

3-Heptanone 2-Heptanone

3-HEPTANOL Suppliers

Global( 124)Suppliers

Supplier	Tel	Email	Country	ProdList	Advantage
Hebei Mojin Biotechnology Co., Ltd	+8613288715578	sales@hbmojin.com	China	12456	58
hebei hongtan Biotechnology Co., Ltd	+86-86-1913198-3935 +8617331935328	sales03@chemcn.cn	China	951	58
Hubei Jusheng Technology Co.,Ltd.	18871490254	linda@hubeijusheng.com	CHINA	28180	58
Hubei xin bonus chemical co. LTD	86-13657291602	linda@hubeijusheng.com	CHINA	22968	58
career henan chemical co	+86-0371-86658258 15093356674;	factory@coreychem.com	China	29826	58
Shaanxi Dideu Medichem Co. Ltd	+86-29-87569266 15319487004	1015@dideu.com	China	2263	58
Hebei Yanxi Chemical Co., Ltd.	+8617531190177	peter@yan-xi.com	China	5993	58
Hefei TNJ Chemical Industry Co.,Ltd.	0551-65418671	sales@tnjchem.com	China	34572	58
Chemsigma International Co., Ltd.	+86-18136843612 +86-19951791336	info@chemsigma.com	China	963	58
Dayang Chem (Hangzhou) Co.,Ltd.	571-88938639 +8617705817739	info@dycnchem.com	CHINA	52867	58

Supplier	Advantage
Hebei Mojin Biotechnology Co., Ltd	58
hebei hongtan Biotechnology Co., Ltd	58
Hubei Jusheng Technology Co.,Ltd.	58
Hubei xin bonus chemical co. LTD	58
career henan chemical co	58
Shaanxi Dideu Medichem Co. Ltd	58
Hebei Yanxi Chemical Co., Ltd.	58
Hefei TNJ Chemical Industry Co.,Ltd.	58
Chemsigma International Co., Ltd.	58
Dayang Chem (Hangzhou) Co.,Ltd.	58

View Lastest Price from 3-HEPTANOL manufacturers

Update time	Product	Price	Min. Order	Purity	Supply Ability	Manufacturer
2024-04-26	3-HEPTANOL 589-82-2	US $40.00 / kg	1kg	99%	1000	hebei hongtan Biotechnology Co., Ltd
2023-11-24	3-HEPTANOL 589-82-2	US $0.00 / KG	1KG	99%	50000KG/month	Hebei Mojin Biotechnology Co., Ltd
2023-09-06	3-HEPTANOL 589-82-2	US $30.00-10.00 / KG	50KG	99%	500000kg	Hebei Guanlang Biotechnology Co., Ltd.

3-HEPTANOL
589-82-2
US $40.00 / kg
99%
hebei hongtan Biotechnology Co., Ltd

3-HEPTANOL
589-82-2
US $0.00 / KG
99%
Hebei Mojin Biotechnology Co., Ltd

3-HEPTANOL
589-82-2
US $30.00-10.00 / KG
99%
Hebei Guanlang Biotechnology Co., Ltd.

3-HEPTANOL Spectrum

3-HEPTANOL(589-82-2)MS 3-HEPTANOL(589-82-2)¹HNMR 3-HEPTANOL(589-82-2)¹³CNMR 3-HEPTANOL(589-82-2)IR1 3-HEPTANOL(589-82-2)Raman

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