Ethyl 2-sulfamoylbenzoate

Modify Date: 2026-08-02 23:29:08

Ethyl 2-sulfamoylbenzoate Structure
Ethyl 2-sulfamoylbenzoate structure
Common Name Ethyl 2-sulfamoylbenzoate
CAS Number 59777-72-9 Molecular Weight 229.253
Density 1.3±0.1 g/cm3 Boiling Point 408.3±47.0 °C at 760 mmHg
Molecular Formula C9H11NO4S Melting Point 83 °C
MSDS N/A Flash Point 200.7±29.3 °C

 Names

Name Ethyl 2-Sulfamoylbenzoate
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.3±0.1 g/cm3
Boiling Point 408.3±47.0 °C at 760 mmHg
Melting Point 83 °C
Molecular Formula C9H11NO4S
Molecular Weight 229.253
Flash Point 200.7±29.3 °C
Exact Mass 229.040878
PSA 94.84000
LogP 0.83
Vapour Pressure 0.0±1.0 mmHg at 25°C
Index of Refraction 1.549
InChIKey CYFKZTWSLPKROH-UHFFFAOYSA-N
SMILES CCOC(=O)c1ccccc1S(N)(=O)=O

 Safety Information

Hazard Codes Xi: Irritant;
HS Code 2935009090

 Synthetic Route

~52%

Ethyl 2-sulfamoylbenzoate Structure

Ethyl 2-sulfamo...

CAS#:59777-72-9

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Literature: Lee, Yu-Ting; Cui, Chang-Jun; Chow, Eve W. L.; Pue, Nason; Lonhienne, Thierry; Wang, Jian-Guo; Fraser, James A.; Guddat, Luke W. Journal of Medicinal Chemistry, 2013 , vol. 56, # 1 p. 210 - 219

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Ethyl 2-sulfamoylbenzoate Structure

Ethyl 2-sulfamo...

CAS#:59777-72-9

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Literature: American Chemical Journal, , vol. 11, p. 334

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Ethyl 2-sulfamoylbenzoate Structure

Ethyl 2-sulfamo...

CAS#:59777-72-9

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Literature: Journal of the Chinese Chemical Society, , vol. 54, # 3 p. 771 - 777

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Ethyl 2-sulfamoylbenzoate Structure

Ethyl 2-sulfamo...

CAS#:59777-72-9

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Literature: DE101483 ; Fortschr. Teerfarbenfabr. Verw. Industriezweige, vol. 5, p. 877

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Ethyl 2-sulfamoylbenzoate Structure

Ethyl 2-sulfamo...

CAS#:59777-72-9

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Literature: Chemische Berichte, , vol. 20, p. 1603

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Ethyl 2-sulfamoylbenzoate Structure

Ethyl 2-sulfamo...

CAS#:59777-72-9

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Literature: Chemische Berichte, , vol. 20, p. 1603

 Customs

HS Code 2935009090
Summary 2935009090 other sulphonamides VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:35.0%

 Ethyl 2-sulfamoylbenzoateBioassay

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Name: Binding affinity against human carbonic anhydrase (hCA).
Source: ChEMBL
Target: Carbonic anhydrase 3
External Id: CHEMBL662691
Name: Binding constant against human Carbonic anhydrase II
Source: ChEMBL
Target: Carbonic anhydrase 2
External Id: CHEMBL828405
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
Name: Partition coefficient (logP)
Source: ChEMBL
Target: N/A
External Id: CHEMBL829145
Name: Cell-based high throughput primary assay to identify activators of GPR151
Source: The Scripps Research Institute Molecular Screening Center
Target: RecName: Full=G-protein coupled receptor 151; AltName: Full=G-protein coupled receptor PGR7; AltName: Full=GPCR-2037; AltName: Full=Galanin receptor 4; AltName: Full=Galanin-receptor-like protein; Short=GalRL
External Id: GPR151_PHUNTER_AG_LUMI_1536_1X%ACT
Name: AlphaScreen-based biochemical high throughput primary assay to identify activators of...
Source: The Scripps Research Institute Molecular Screening Center
Target: N/A
External Id: FBW7_ACT_ALPHA_1536_1X%ACT PRUN
Name: AlphaScreen-based biochemical high throughput primary assay to identify inhibitors of...
Source: The Scripps Research Institute Molecular Screening Center
External Id: MITF_INH_Alpha_1536_1X%INH PRUN
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 Synonyms

MFCD00455715
Ethyl 2-(Aminosulfonyl)benzoate
Ethyl 2-sulfamoylbenzoate
o-Carboethoxybenzene sulfonamide
Benzoic acid, 2-(aminosulfonyl)-, ethyl ester
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