Cas no 98-73-7 (4-Tert-Butylbenzoic acid)
4-Tert-Butylbenzoic acid is a versatile, crystalline solid offering improved thermal stability compared to its parent compound. Its 4-t-butyl substitution enhances solubility in certain organic solvents and can modulate acid dissociation constants. This modification enables applications where thermal robustness is crucial alongside the characteristic properties of benzoic acids.
4-Tert-Butylbenzoic acid structure
Product Name:4-Tert-Butylbenzoic acid
CAS No:98-73-7
MF:C11H14O2
MW:178.227663516998
MDL:MFCD00002563
CID:34975
PubChem ID:7403
Update Time:2026-05-14
4-Tert-Butylbenzoic acid Chemical and Physical Properties
Names and Identifiers
-
- 4-(tert-Butyl)benzoic acid
- PTBBA
- P-T-BUTYLBENZOIC ACID
- P-TERT-BUTYLBENZOIC ACID
- RARECHEM AL BO 0693
- 4-(1,1-dimethylethyl)-benzoicaci
- 4-(1,1-dimethylethyl)benzoicacid
- 4-(1,1-dimethylethyl)-Benzoicacid
- 4-tbba
- 4-t-butylbenzoic acid
- 4-tert-butyl-benzoicaci
- acidetert-butyl-4benzoique
- Benzoic acid, 4-(1,1-dimethylethyl)-
- butylbenzoicacid
- Kyselina p-terc.butylbenzoova
- p-sec-Butylbenzoic acid
- p-Secondary-butylbenzoic acid
- 4-?tert-?Butylbenzoic Acid
- 4-Tert.-Butylbenzoic Acid
- 4-tert-Butylbenzoic acid
- 4-t-Bu-benzoic acid
- 4-tert-Bu-lbenzoic acid
- 4-tert-butyl-benzoic acid
- Benzoic acid,4-tert-butyl
- Benzoic acid,p-tert-butyl
- Methyl 4-tert-butylbenzoate
- para-tert-butylbenzoic acid
- TBBA
- 對叔丁基苯甲酸
- Benzoic acid, p-tert-butyl-
- 4-tert-Butylbenzoicacid
- Benzoic acid, 4-tert-butyl-
- Kyselina p-terc.butylbenzoova [Czech]
- 43Z7T3VN0R
- KDVYCTOWXSLNNI-UHFFFAOYSA-N
- 4-(1,1-dimethyleth
- 4-Tert-Butylbenzoic acid
-
- MDL： MFCD00002563
- Inchi： 1S/C11H14O2/c1-11(2,3)9-6-4-8(5-7-9)10(12)13/h4-7H,1-3H3,(H,12,13)
- InChI Key： KDVYCTOWXSLNNI-UHFFFAOYSA-N
- SMILES： O([H])C(C1C([H])=C([H])C(=C([H])C=1[H])C(C([H])([H])[H])(C([H])([H])[H])C([H])([H])[H])=O
- BRN： 0607545
Computed Properties
- Exact Mass: 178.09900
- Monoisotopic Mass: 178.09938
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 13
- Rotatable Bond Count: 2
- Complexity: 183
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 3.9
- Topological Polar Surface Area: 37.3
- Surface Charge: 0
Experimental Properties
- Color/Form: Colorless needle crystal or fine crystalline powder.
- Density: 0.6
- Melting Point: 162-165?°C (lit.)
- Boiling Point: 280°C
- Flash Point: Fahrenheit: 316.4 ° f < br / > Celsius: 158 ° C < br / >
- Refractive Index: 1.5201 (estimate)
- PH: 3.9 (H2O, 20℃)(saturated solution)
- Solubility: 12.6g/l
- Water Partition Coefficient: 0.07 g/L (20 oC)
- PSA: 37.30000
- LogP: 2.68230
- pka: 4.38(at 25℃)
- Solubility: Soluble in ethanol and benzene, insoluble in water.
- Sensitiveness: Sensitive to humidity
4-Tert-Butylbenzoic acid Security Information
-
Symbol:
- Prompt：dangerous
- Signal Word：Danger
- Hazard Statement： H302,H311,H332
- Warning Statement： P280,P312
- Hazardous Material transportation number：UN 2811 6.1/PG 3
- WGK Germany：3
- Hazard Category Code： 20/22
- Safety Instruction： S22-S24/25-S61-S45-S36/37/39-S28A
- RTECS：DG4708000
-
Hazardous Material Identification：
- HazardClass：6.1
- PackingGroup：III
- TSCA：Yes
- Storage Condition：Store at room temperature
- Safety Term：6.1
- Packing Group：III
- Risk Phrases：R20/22; R24; R48/20/21/22; R51/53; R62
4-Tert-Butylbenzoic acid Customs Data
- HS CODE：29163900
- Customs Data：
China Customs Code:
2916399090Overview:
2916399090 Other aromatic monocarboxylic acids. VAT:17.0% Tax refund rate:9.0% Regulatory conditions:nothing MFN tariff:6.5% general tariff:30.0%
Declaration elements:
Product Name, component content, use to, Acrylic acid\Acrylates or esters shall be packaged clearly
Summary:
2916399090 other aromatic monocarboxylic acids, their anhydrides, halides, peroxides, peroxyacids and their derivatives VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0%
4-Tert-Butylbenzoic acid Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| SHANG HAI XIAN DING Biotechnology Co., Ltd. | B0717-25g |
4-Tert-Butylbenzoic acid |
98-73-7 | 99.0%(T) | 25g |
￥135.0 | 2022-05-30 | |
| SHANG HAI XIAN DING Biotechnology Co., Ltd. | B0717-500g |
4-Tert-Butylbenzoic acid |
98-73-7 | 99.0%(T) | 500g |
￥320.0 | 2022-05-30 | |
| SHANG HAI XIAN DING Biotechnology Co., Ltd. | T137A-100g |
4-Tert-Butylbenzoic acid |
98-73-7 | 99% | 100g |
￥39.0 | 2022-05-30 | |
| SHANG HAI XIAN DING Biotechnology Co., Ltd. | T137A-500g |
4-Tert-Butylbenzoic acid |
98-73-7 | 99% | 500g |
￥83.0 | 2022-05-30 | |
| Fluorochem | 078571-1g |
4-tert-Butylbenzoic acid |
98-73-7 | 99% | 1g |
￡10.00 | 2022-03-01 | |
| Fluorochem | 078571-25g |
4-tert-Butylbenzoic acid |
98-73-7 | 99% | 25g |
￡11.00 | 2022-03-01 | |
| Fluorochem | 078571-100g |
4-tert-Butylbenzoic acid |
98-73-7 | 99% | 100g |
￡17.00 | 2022-03-01 | |
| Fluorochem | 078571-5kg |
4-tert-Butylbenzoic acid |
98-73-7 | 99% | 5kg |
￡470.00 | 2022-03-01 | |
| SHANG HAI A LA DING SHENG HUA KE JI GU FEN Co., Ltd. | B104400-25g |
4-Tert-Butylbenzoic acid |
98-73-7 | 99% | 25g |
￥30.90 | 2023-09-04 | |
| SHANG HAI A LA DING SHENG HUA KE JI GU FEN Co., Ltd. | B104400-2.5kg |
4-Tert-Butylbenzoic acid |
98-73-7 | 99% | 2.5kg |
￥321.90 | 2023-09-04 |
4-Tert-Butylbenzoic acid Suppliers
Suzhou Senfeida Chemical Co., Ltd
Gold Member
Audited Supplier
(CAS:98-73-7)4-tert-Butylbenzoic acid
Order Number:sfd4895
Stock Status:in Stock
Quantity:200kg
Purity:99.9%
Pricing Information Last Updated:Friday, 19 July 2024 14:33
Price ($):discuss personally
Email:[email protected]
Tiancheng Chemical (Jiangsu) Co., Ltd
Gold Member
Audited Supplier
(CAS:98-73-7)PTBBA
Order Number:LE18305;LE5904;LE5679050
Stock Status:in Stock
Quantity:25KG,200KG,1000KG
Purity:99%
Pricing Information Last Updated:Friday, 20 June 2025 12:19
Price ($):discuss personally
Email:[email protected]
4-Tert-Butylbenzoic acid Related Literature
-
Shaun D. Wong,Edward I. Solomon Dalton Trans., 2014,43, 17567-17577
-
2. Fatty acid eutectic mixtures and derivatives from non-edible animal fat as phase change materials?Pau Gallart-Sirvent,Marc Martín,Gemma Villorbina,Mercè Balcells,Aran Solé,Luisa F. Cabeza,Ramon Canela-Garayoa RSC Adv., 2017,7, 24133-24139
-
Hongxia Li,Aikifa Raza,Qiaoyu Ge,Jin-You Lu,TieJun Zhang Soft Matter, 2020,16, 6841-6849
-
Chen-Yu Chien,Sheng-Sheng Yu Chem. Commun., 2020,56, 11949-11952
98-73-7 (4-Tert-Butylbenzoic acid) Related Products
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- 4980-54-5(Benzoic acid,4-(1,1-dimethylethyl)-, zinc salt (2:1))
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Recommended suppliers
Suzhou Senfeida Chemical Co., Ltd
(CAS:98-73-7)4-tert-Butylbenzoic acid
Purity:99.9%
Quantity:200kg
Price ($):Inquiry
Tiancheng Chemical (Jiangsu) Co., Ltd
(CAS:98-73-7)PTBBA
Purity:99%/99%/99%
Quantity:25KG,200KG,1000KG/25KG,200KG,1000KG/25KG,200KG,1000KG
Price ($):Inquiry/Inquiry/Inquiry