7-Fluoro-2,2-dimethylchroman-4-one - CAS 111477-98-6

Name: 7-Fluoro-2,2-dimethylchroman-4-one
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB002765
Product Name:	7-Fluoro-2,2-dimethylchroman-4-one
CAS:	111477-98-6
Synonyms:	7-fluoro-2,2-dimethyl-3,4-dihydro-2H-1-benzopyran-4-one; 7-fluoro-2,2-dimethyl-3H-chromen-4-one

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	7-fluoro-2,2-dimethyl-3H-chromen-4-one
Description:	7-Fluoro-2,2-dimethylchroman-4-one (CAS# 111477-98-6) is a useful research chemical.
Molecular Weight:	194.20
Molecular Formula:	C11H11FO2
Canonical SMILES:	CC1(CC(=O)C2=C(O1)C=C(C=C2)F)C
InChI:	InChI=1S/C11H11FO2/c1-11(2)6-9(13)8-4-3-7(12)5-10(8)14-11/h3-5H,6H2,1-2H3
InChI Key:	MWTQZPUQPCIGJM-UHFFFAOYSA-N
LogP:	2.56950

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

[959574-98-2]C11H10N2O2
(3-Phenyl-1H-pyrazol-1-yl)acetic acid
[1035840-45-9]C14H16N2O4
1-(5-Methoxy-1,3-benzoxazol-2-yl)piperidine-3-carboxylic acid
[956439-56-8]C6H5N3O6
1-(Carboxymethyl)-3-nitro-1H-pyrazole-5-carboxylic acid
[70912-52-6]C10H13NO4
1,3-Dioxane-4,6-dione,2,2-dimethyl-5-(2-pyrrolidinylidene)-
[1431966-64-1]C10H17ClN2O2S
1-{2-[(3-Methoxypropyl)amino]-4-methyl-1,3-thiazol-5-yl}ethanone hydrochloride
[865774-78-3]C16H21F2NO2
2-(6,8-difluoro-1,2,3,4-tetrahydro-naphthalen-2-ylamino)-pentanoic acid methyl ester

GHS Hazard Statement:	H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word:	Warning

Publication Number	Title	Priority Date
CA-2737768-A1	Trpv1 antagonists	20081017
CA-2737775-A1	Trpv1 antagonists	20081017
EP-2352726-A1	Trpv1 antagonists	20081017
EP-2352727-A1	Trpv1 antagonists	20081017
JP-2012505908-A	TRPV1 antagonist	20081017

Complexity:	250
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	194.07430775
Formal Charge:	0
Heavy Atom Count:	14
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	194.07430775
Rotatable Bond Count:	0
Topological Polar Surface Area:	26.3 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.1