Completing data — usually done within a minute
Basic information
- CAS
32760-16-0- Standard SMILES
CCCCNc1ccc(C(=O)O)cc1- InChIKey
YCCRFDDXAVMSLM-UHFFFAOYSA-N- Molecular formula
- C11H15NO2
- Average molar mass
- 193.246 g/mol
- Monoisotopic mass
- 193.11027872
Names & identifiers
- Preferred name
- 4-n-Butylaminobenzoic acid
- IUPAC
- 4-(Butylamino)benzoic acid
- English name
- 4-(Butylamino)benzoic acid
- Molecular formula
- C11H15NO2
- Molecular weight
- 193.24
Names & synonyms
NSC44300NSC 44300SMR000413195MLS000776796CBDivE_002387STOCK1S-53913262412_ALDRICHTetracaine Impurity BLABOTEST-BB LT00000179Tetracaine EP Impurity B
Database identifiers
- CAS
32760-16-0、4740-24-3- PubChem CID
- 95946
- DTXSID
DTXSID60197127- ChEMBL
CHEMBL253121- ChEBI
CHEBI:521021- UNII
- KGL80FSD2F
- EC Number
- 628-333-2
- Nikkaji
- J26.948D
Properties
Physicochemical properties
- Melting point
- 149 · 149-151 °C(lit.)
- Boiling point
- 353.5 · 353.5±25.0 °C(Predicted)
- Density
- 1.13 · 1.130±0.06 g/cm3(Predicted)
- storage temp.
- Keep in dark place,Inert atmosphere,Room temperature
- solubility
- Chloroform (Slightly), Methanol (Slightly)
- pka
- 4.77 · 4.77±0.10(Predicted)
- form
- Solid
- color
- Off-White to Pale Beige
- Major Application
- peptide synthesis
- InChI
- 1S/C11H15NO2/c1-2-3-8-12-10-6-4-9(5-7-10)11(13)14/h4-7,12H,2-3,8H2,1H3,(H,13,14)
- InChIKey
- YCCRFDDXAVMSLM-UHFFFAOYSA-N
- SMILES
- CCCCNc1ccc(cc1)C(O)=O
- FDA UNII
- 80 FSD2F · KGL80FSD2F
- UNSPSC Code
- 41116107 · 41116107
- NACRES
- 24 · NA.24
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335
- Precautionary statements
- 261 · P261-P264-P271-P280-P302+P352-P305+P351+P338
- target organs
- Respiratory system
- PPE
- 95 · dust mask type N95 (US), Eyeshields, Gloves
- Hazard Codes
- Xi
- Risk Statements
- 36 · 36/37/38
- Safety Statements
- 26 · 26-37/39
- WGK Germany
- 3 · 3
- HS Code
- 2922493800 · 2922493800
- Storage Class
- 11 · 11 - Combustible Solids
- Hazard Classifications
- 2 Skin · Eye Irrit. 2Skin Irrit. 2STOT SE 3
Safety & regulation
Safety data
- PPE
- dust mask type N95 (US), Eyeshields, Gloves
- wgk
- 3
- hs_code
- 2922493800
- risk_code
- 36/37/38
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- safety_code
- 26-37/39
- Storage Class
- 11 - Combustible Solids
- target organs
- Respiratory system
- Hazard statements
- H315-H319-H335
- Hazard Classifications
- Eye Irrit. 2Skin Irrit. 2STOT SE 3
- Precautionary statements
- P261-P264-P271-P280-P302+P352-P305+P351+P338
Chemistry & industry
Applications
Uses4-(Butylamino)benzoic Acid is an intermediate used to synthesize 5-nitrothiophene derivatives with antimicrobial activity against multidrug-resistant Staphylococcus aureus.
Upstream & downstream products
Upstream raw materials
Downstream products
Suppliers13 total
艾吉析科技（上海）有限公司17717235263 · [email protected]
安耐吉化学&3A（安徽泽升科技有限公司）021-58432009 400-005-6266 · [email protected]
上海陶素生化科技有限公司021-33632979 · [email protected]
Cato Research Chemicals Inc.020-81960175 · [email protected]
凯试（上海）科技有限公司021-50135380 · [email protected]
上海阿拉丁生化科技股份有限公司6206333 13167063860 · [email protected]
上海源叶生物科技有限公司13636370518 · [email protected]
成都标样生物科技有限公司028-81700200 13308200041 · [email protected]
深圳聚合生化科技有限公司+86-400-002-6226 · [email protected]
Aladdin Scientific[email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
TargetMol中国（陶术生物）15002134094 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
Additional notes
DefinitionChEBI: 4-Aminobenzoic acid in which one of the hydrogens attached to the nitrogen is substituted by a butyl group.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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