3-(1H-Tetrazol-5-yl)benzoic Acid - CAS 73096-39-6

Catalog:	BB034764
Product Name:	3-(1H-Tetrazol-5-yl)benzoic Acid
CAS:	73096-39-6
Synonyms:	3-(2H-tetrazol-5-yl)benzoic acid; 3-(2H-tetrazol-5-yl)benzoic acid

Technical Data

Safety and Hazards

Patents

Literatures

Computed Properties

IUPAC Name:	3-(2H-tetrazol-5-yl)benzoic acid
Description:	3-(1H-Tetrazol-5-yl)benzoic Acid (CAS# 73096-39-6) is a useful reactant in organic synthesis.
Molecular Weight:	190.16
Molecular Formula:	C8H6N4O2
Canonical SMILES:	C1=CC(=CC(=C1)C(=O)O)C2=NNN=N2
InChI:	InChI=1S/C8H6N4O2/c13-8(14)6-3-1-2-5(4-6)7-9-11-12-10-7/h1-4H,(H,13,14)(H,9,10,11,12)
InChI Key:	MIERACSHCALJOM-UHFFFAOYSA-N
Boiling Point:	496.4 °C at 760 mmHg
Density:	1.518 g/cm³
MDL:	MFCD03821131
LogP:	0.56490

Publication Number	Title	Priority Date
TW-201925413-A	Chemical mechanical polishing composition	20171122
EP-3350177-A1	Heteroaryl compounds as irak inhibitors and uses thereof	20150918
WO-2017049068-A1	Heteroaryl compounds as irak inhibitors and uses thereof	20150918
EP-2925322-A1	Inhibitors of the renal outer medullary potassium channel	20121129
WO-2014085210-A1	Inhibitors of the renal outer medullary potassium channel	20121129

PMID	Publication Date	Title	Journal
19301919	20090420	Tuning the framework topologies of Co(II)-doped Zn(II)-tetrazole-benzoate coordination polymers by ligand modifications: structures and spectral studies	Inorganic chemistry
21581726	20081210	3-(1H-Tetra-zol-5-yl)benzoic acid	Acta crystallographica. Section E, Structure reports online

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

[87-88-7]
Chloranilic acid
[1383427-98-2]
(S)-Hexahydropyrazino[2,1-c][1,4]oxazin-4(3H)-one hydrochloride
[17746-05-3]
Undecanoyl chloride
[959574-98-2]
(3-Phenyl-1H-pyrazol-1-yl)acetic acid
[1035840-45-9]
1-(5-Methoxy-1,3-benzoxazol-2-yl)piperidine-3-carboxylic acid
[1006443-01-1]
1-(5-Nitropyridin-2-yl)-1H-pyrazole-3-carboxylic acid

Customers Also Viewed

[132182-92-4]
Pentane, 1,1,1,2,2,3,4,5,5,5-decafluoro-3-methoxy-4-(trifluoromethyl)-
[74927-72-3]
(R)-(-)-N-(3,5-Dinitrobenzoyl)-alpha-phenylglycine
[4294-16-0]
N6-Benzyl Adenosine
[10128-55-9]
N-[2-(4-oxo-4H-3,1-benzoxazin-2-yl)phenyl]-2-naphthalenesulfonamide
[94086-78-9]
Isopropyl 4-[4-[N,N-bis(2-hydroxyethyl)amino]phenyl]butyrate
[75726-96-4]
2-Bromo-N-isopropylacetamide

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:	H302 (20%): 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

Complexity:	223
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	190.04907545
Formal Charge:	0
Heavy Atom Count:	14
Hydrogen Bond Acceptor Count:	5
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	190.04907545
Rotatable Bond Count:	2
Topological Polar Surface Area:	91.8 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	0.7