4-Azidobenzoic acid supplier

Name
4-AZIDOBENZOIC ACID
EINECS 229-198-9
CAS No. 6427-66-3
Article Data94
CAS DataBase
Density 1.352g/mLat 25°C(lit.)
Solubility
Melting Point 180 °C(Solv: water (7732-18-5))
Formula C₇H₅N₃O₂
Boiling Point 73-75°C0.35mm Hg(lit.)
Molecular Weight 163.136
Flash Point 195°F
Transport Information
Appearance
Safety 15-26-36/37/39
Risk Codes 5-36/37/38
Molecular Structure
Hazard Symbols F,Xn
Synonyms Benzoicacid, p-azido- (6CI,7CI,8CI);4-Azidobenzoic acid;4-Carboxyphenyl azide;NSC80932;p-Azidobenzoic acid;
PSA 87.05000
LogP 1.77936

4-Azidobenzoic acid Specification

The Benzoic acid, 4-azido-, with the CAS registry number 6427-66-3, is also known as p-Azidobenzoic acid. Its EINECS registry number is 229-198-9. This chemical's molecular formula is C₇H₅N₃O₂ and molecular weight is 163.1335. Its IUPAC name is called 4-azidobenzoic acid.

Physical properties of Benzoic acid, 4-azido-: (1)ACD/LogP: 2.54; (2)ACD/LogD (pH 5.5): 1.11; (3)ACD/LogD (pH 7.4): -0.39; (4)ACD/BCF (pH 5.5): 1.88; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 21.5; (7)ACD/KOC (pH 7.4): 1; (8)#H bond acceptors: 5; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 2.

When you are using this chemical, please be cautious about it as the following:
This chemical is irritating to eyes, respiratory system and skin. In case of contact with eyes, you should rinse immediately with plenty of water and seek medical advice. Whenever you will contact it, please wear suitable protective clothing, gloves and eye/face protection.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: C1=CC(=CC=C1C(=O)O)N=[N+]=[N-]
(2)InChI: InChI=1S/C7H5N3O2/c8-10-9-6-3-1-5(2-4-6)7(11)12/h1-4H,(H,11,12)
(3)InChIKey: PQXPAFTXDVNANI-UHFFFAOYSA-N

Product Name

4-AZIDOBENZOIC ACID

4-Azidobenzoic acid Specification

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