4-(tert-Pentyl)cyclohexanone - CAS 16587-71-6

Catalog:	BB012224
Product Name:	4-(tert-Pentyl)cyclohexanone
CAS:	16587-71-6
Synonyms:	4-(2-methylbutan-2-yl)-1-cyclohexanone; 4-(2-methylbutan-2-yl)cyclohexan-1-one

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	4-(2-methylbutan-2-yl)cyclohexan-1-one
Description:	4-(tert-Pentyl)cyclohexanone (CAS# 16587-71-6 ) is a useful research chemical.
Molecular Weight:	168.28
Molecular Formula:	C11H20O
Canonical SMILES:	CCC(C)(C)C1CCC(=O)CC1
InChI:	InChI=1S/C11H20O/c1-4-11(2,3)9-5-7-10(12)8-6-9/h9H,4-8H2,1-3H3
InChI Key:	DCSKAMGZSIRJAQ-UHFFFAOYSA-N
Boiling Point:	230.7 °C at 760 mmHg
Flash Point:	86.1°C
Density:	0.906 g/cm³
Solubility:	water, 78.72 mg/L @ 25 °C (est)
Appearance:	Liquid
MDL:	MFCD00013798
LogP:	3.18190
Refractive Index:	1.469

Publication Number	Title	Priority Date
EP-3900696-A1	Encapsulated fragrance composition	20200421
EP-3900697-A1	Fragrance composition	20200421
US-2021324298-A1	Fragrance composition	20200421
US-2021324299-A1	Encapsulated fragrance composition	20200421
DE-102020204505-A1	Laundry / care articles comprising pheromones	20200407

Related Products

Online Inquiry

Name:

* Phone:

* Service & Products of Interested:

Project Description:

* Quantity:

* Email:

* Verification Code:

Customer Support

If the product you need is not in our catalog, please contact us in time to submit your needs. You can help our website get better and better. Why not submit the request today?

Submit Requirement

Customer Centered

Global Delivery

Warehouses in multiple cities to ensure fast delivery

Quality Assurance

Strict process parameter control to ensure product quality

Large Stock

> 20,000 building blocks and intermediates from stock

Process Scale-up

Process scale-up from lab to industrial scale

Flexible Batch Size

Flexible batch size for diverse industrial demands

Related Functional Groups

Carbonyl Compounds

[89908-23-6]
2-Propenoic acid, 2-(3',3'-dimethyl-6-nitrospiro[2H-1-benzopyran-2,2'-[2H]indol]-1'(3'H)-yl)ethyl ester
[55441-25-3]
1-(2-Cyanophenyl)urea
[70912-52-6]
1,3-Dioxane-4,6-dione,2,2-dimethyl-5-(2-pyrrolidinylidene)-
[1431966-64-1]
1-{2-[(3-Methoxypropyl)amino]-4-methyl-1,3-thiazol-5-yl}ethanone hydrochloride
[91552-11-3]
2-(3-Chlorophenyl)cyclopropanecarboxylic Acid
[957292-12-5]
2-(3-Cyclopropyl-1H-pyrazol-1-yl)acetic acid

Customers Also Viewed

[30360-19-1]
N,N'-Diethyl-N''-isopropyl-1,3,5-triazine-2,4,6-triamine
[332360-02-8]
Mitoguazone dihydrochloride monohydrate
[24292-52-2]
Hesperidin methyl chalcone
[79551-14-7]
Ferene Disodium Salt
[597-35-3]
ethylsulfone
[852913-16-7]
N-[3,5-Bis(trifluoromethyl)phenyl]-N-[(8a,9S)-6-methoxy-9-cinchonanyl]thiourea

INDUSTRY LEADERS TRUST OUR PRODUCTS

Phone

US & Canada (Toll free):

UK:

International:

E-mail & Fax

E-mail:

Fax:

Address

USA:

UK:

Our Products

Inquiry Basket

Loading ......

Delete selected Go to checkout

GHS Hazard Statement:	H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
Precautionary Statement:	P264, P280, P302+P352, P321, P332+P313, and P362
Signal Word:	Warning

Complexity:	160
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	168.151415257
Formal Charge:	0
Heavy Atom Count:	12
Hydrogen Bond Acceptor Count:	1
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	168.151415257
Rotatable Bond Count:	2
Topological Polar Surface Area:	17.1 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.9