3-(3,5-Dimethylisoxazol-4-yl)propanoic acid - CAS 116423-07-5

Catalog:	BB003753
Product Name:	3-(3,5-Dimethylisoxazol-4-yl)propanoic acid
CAS:	116423-07-5
Synonyms:	3-(3,5-dimethyl-1,2-oxazol-4-yl)propanoic acid

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	3-(3,5-dimethyl-1,2-oxazol-4-yl)propanoic acid
Description:	3-(3,5-Dimethylisoxazol-4-yl)propanoic acid (CAS# 116423-07-5) is a useful research chemical.
Molecular Weight:	169.18
Molecular Formula:	C8H11NO3
Canonical SMILES:	CC1=C(C(=NO1)C)CCC(=O)O
InChI:	InChI=1S/C8H11NO3/c1-5-7(3-4-8(10)11)6(2)12-9-5/h3-4H2,1-2H3,(H,10,11)
InChI Key:	KSKLKJYVYVPIFW-UHFFFAOYSA-N
Boiling Point:	330.9 °C at 760 mmHg
Purity:	95 %
Density:	1.191 g/cm³
MDL:	MFCD02628165
LogP:	1.30860

Publication Number	Title	Priority Date
CN-1898244-B	Triazole derivatives as vasopressin antagonists	20031222
EP-1701959-A1	Triazole derivatives as vasopressin antagonists	20031222
JP-2007515468-A	Triazole derivatives as vasopressin antagonists	20031222
JP-4698604-B2	Triazole derivatives as vasopressin antagonists	20031222
KR-100854872-B1	Triazole Derivatives as Vasopressin Antagonists	20031222

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

Isoxazoles

[1018168-48-3]
2-[(5-Methyl-1,2-oxazol-3-yl)methoxy]acetic acid
[712347-12-1]
3-(2-Chloro-6-fluorophenyl)-4,5-dihydroisoxazole-5-carboxylic acid
[618383-47-4]
3-(4-Methoxyphenyl)isoxazole-5-carboxylic acid
[40279-32-1]
Ethyl 2-(methylthio)-1,3-thiazole-4-carboxylate
[640291-92-5]
Ethyl 5-(4-fluorophenyl)isoxazole-3-carboxylate
[625120-13-0]
Ethyl 5-(trifluoromethyl)isoxazole-3-carboxylate

Customers Also Viewed

[1184173-73-6]
MK-8353
[582-16-1]
2,7-Dimethylnaphthalene
[6315-52-2]
Ethylene di(p-toluenesulfonate)
[75726-96-4]
2-Bromo-N-isopropylacetamide
[132182-92-4]
Pentane, 1,1,1,2,2,3,4,5,5,5-decafluoro-3-methoxy-4-(trifluoromethyl)-
[57166-92-4]
Methylenediamine dihydrochloride

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:	P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	172
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	169.07389321
Formal Charge:	0
Heavy Atom Count:	12
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	169.07389321
Rotatable Bond Count:	3
Topological Polar Surface Area:	63.3 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	0.9