CAS No.42823-72-3,4-AMIDINOBENZOIC ACID HCL Suppliers

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Basic Information

Molecular Structure:
CAS No.:	42823-72-3
Name:	4-AMIDINOBENZOIC ACID HCL
Article Data:	3

Formula:	C₈H₉ClN₂O₂
Molecular Weight:	200.625
Synonyms:	Benzoicacid, 4-(aminoiminomethyl)-, monohydrochloride (9CI);4-Amidinobenzoic acidhydrochloride;p-Amidinobenzoic acid hydrochloride;
Boiling Point:	366.5 °C at 760 mmHg
Flash Point:	175.4 °C
Hazard Symbols:	Xn
Risk Codes:	36/37/38
Safety:	26-36/37/39
PSA:	87.17000
LogP:	2.27090

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Specification

The Benzoicacid, 4-(aminoiminomethyl)-, hydrochloride (1:1), with the CAS registry number 42823-72-3, is also known as 4-Carbamimidoyl-benzoic acid hydrochloride. It belongs to the product categories of Aromatic Carboxylic Acids, Amides, Anilides, Anhydrides & Salts; Pharmacetical. This chemical's molecular formula is C₈H₉ClN₂O₂ and molecular weight is 200.035255. Its IUPAC name is called (4-carboxybenzenecarboximidoyl)azanium chloride.

Physical properties of Benzoicacid, 4-(aminoiminomethyl)-, hydrochloride (1:1): (1)ACD/LogP: 0.76; (2)#H bond acceptors: 4; (3)#H bond donors: 4; (4)#Freely Rotating Bonds: 2; (5)Flash Point: 175.4 °C; (6)Enthalpy of Vaporization: 64.66 kJ/mol; (7)Boiling Point: 366.5 °C at 760 mmHg; (8)Vapour Pressure: 5.15E-06 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
It 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(=N)[NH3+])C(=O)O.[Cl-]
(2)InChI: InChI=1S/C8H8N2O2.ClH/c9-7(10)5-1-3-6(4-2-5)8(11)12;/h1-4H,(H3,9,10)(H,11,12);1H
(3)InChIKey: LWZWTSNXTMLZNG-UHFFFAOYSA-N