Isohexylamine Hydrochloride Salt - CAS 116008-13-0

Catalog:	BB063868
Product Name:	Isohexylamine Hydrochloride Salt
CAS:	116008-13-0
Synonyms:	4-Methyl-1-pentanamine Hydrochloride

Technical Data

Safety and Hazards

Computed Properties

IUPAC Name:	4-methylpentan-1-aminehydrochloride
Description:	Isohexylamine Hydrochloride Salt is an analog of Isohexylamine (I819643).Isohexylamine Hydrochloride Salt was used in catalytic alkylation of remote C-H bonds enabled by proton-coupled electron transfer.
Molecular Weight:	101.19 + 36.46
Molecular Formula:	C6H15N·HCl
Canonical SMILES:	CC(C)CCCN.Cl
InChI:	InChI=1S/C6H15N.ClH/c1-6(2)4-3-5-7/h6H,3-5,7H2,1-2H31H
InChI Key:	YQZPRXHVRLGGFH-UHFFFAOYSA-N
References:	Choi, G., et al. Nature, 539, 268 (2016).

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

Other Building Blocks

[86271-48-9]
5-[Bis(2-hydroxyethyl)amino]-2-pentanone
[1306615-47-3]
Desthiobiotin-TEG Azide
[1212679-29-2]
(3R,4R)-N-(3-Cyanophenyl)-3-[[4-[(4-fluorophenyl)methoxy]benzoyl]amino]hexahydro-4-hydroxy-1H-azepine-1-carboxamide
[1354469-76-3]
(3R,4R)-N,4-Dimethyl-piperidin-3-amine
[24177-07-9]
(2R,5S,10aS,10bS)-Octahydro-10b-hydroxy-5-isobutyl-2-isopropyl-3,6-dioxo-8H-oxazolo[3,2-a]pyrrolo[2,1-c]pyrazine-2-carboxylic Acid
(2R,5S,10aS,10bS)-10b-Hydroxy-5-isopropyl-2-methyl-3,6-dioxooctahydro-2H-oxazolo[3,2-a]pyrrolo[2,1-c]pyrazine-2-carboxylic Acid

GHS Hazard Statement:	H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
Precautionary Statement:	P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	33.2
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	2
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	137.0971272
Formal Charge:	0
Heavy Atom Count:	8
Hydrogen Bond Acceptor Count:	1
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	137.0971272
Rotatable Bond Count:	3
Topological Polar Surface Area:	26Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0