3-(1H-Tetrazol-5-yl)benzoic Acid

Modify Date: 2026-08-23 15:56:30

3-(1H-Tetrazol-5-yl)benzoic Acid Structure
3-(1H-Tetrazol-5-yl)benzoic Acid structure
Common Name 3-(1H-Tetrazol-5-yl)benzoic Acid
CAS Number 73096-39-6 Molecular Weight 190.15900
Density 1.518 g/cm3 Boiling Point 496.4ºC at 760 mmHg
Molecular Formula C8H6N4O2 Melting Point 284-286ºC
MSDS N/A Flash Point 254ºC

 Names

Name 3-(2H-tetrazol-5-yl)benzoic acid
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.518 g/cm3
Boiling Point 496.4ºC at 760 mmHg
Melting Point 284-286ºC
Molecular Formula C8H6N4O2
Molecular Weight 190.15900
Flash Point 254ºC
Exact Mass 190.04900
PSA 91.76000
LogP 0.56490
Index of Refraction 1.664
InChIKey MIERACSHCALJOM-UHFFFAOYSA-N
SMILES O=C(O)c1cccc(-c2nn[nH]n2)c1

 Safety Information

HS Code 2933990090

 Synthetic Route

~59%

3-(1H-Tetrazol-5-yl)benzoic Acid Structure

3-(1H-Tetrazol-...

CAS#:73096-39-6

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Literature: Carter, Percy H.; Cherney, Robert J.; Batt, Douglas G.; Brown, Gregory D.; Duncia, John V.; Gardner, Daniel S.; Yang, Michael G. Patent: US2005/54626 A1, 2005 ; Location in patent: Page/Page column 44 ; US 20050054626 A1

~74%

3-(1H-Tetrazol-5-yl)benzoic Acid Structure

3-(1H-Tetrazol-...

CAS#:73096-39-6

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Literature: Goldstein, Steven Wayne; Lowe III, John Adams; Longo, Kelly Porter; Awad, Mohamed Mohamed Ali; Subramanyam, Chakrapani; Dorff, Peter Hans Patent: US2003/191279 A1, 2003 ; US 20030191279 A1

~%

3-(1H-Tetrazol-5-yl)benzoic Acid Structure

3-(1H-Tetrazol-...

CAS#:73096-39-6

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Literature: ChemMedChem, , vol. 7, # 10 p. 1825 - 1839

~%

3-(1H-Tetrazol-5-yl)benzoic Acid Structure

3-(1H-Tetrazol-...

CAS#:73096-39-6

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Literature: ChemMedChem, , vol. 7, # 10 p. 1825 - 1839

 Customs

HS Code 2933990090
Summary 2933990090. heterocyclic compounds with nitrogen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

 3-(1H-Tetrazol-5-yl)benzoic AcidBioassay

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Name: Discovery of Small Molecules to Inhibit Human Cytomegalovirus Nuclear Egress
Source: ICCB-Longwood/NSRB Screening Facility, Harvard Medical School
Target: HCMV UL50
External Id: HMS1262
Name: High-throughput screen for inhibitors of the GIV GBA-motif interaction with Galpha-i ...
Source: ICCB-Longwood/NSRB Screening Facility, Harvard Medical School
External Id: HMS1303
Name: A screen for compounds that inhibit the activity of LtaS in Staphylococcus aureus
Source: ICCB-Longwood/NSRB Screening Facility, Harvard Medical School
External Id: HMS979
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 Synonyms

3-Tetrazolylbenzoic acid
meta-carboxy-5-phenyltetrazole
MFCD03821131
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