(2-Amino-4-methoxycarbonylphenyl)boronic acid hydrochloride supplier

Name
(2-Amino-4-methoxycarbonylphenyl)boronic acid hydrochloride
EINECS
CAS No. 380430-55-7
Density
Solubility
Melting Point 200-204 °C
Formula C₈H₁₁BClNO₄
Boiling Point 427.6 °C at 760 mmHg
Molecular Weight 231.444
Flash Point 212.4 °C
Transport Information
Appearance
Safety 26-36/37/39
Risk Codes 36/37/38
Molecular Structure
Hazard Symbols
Synonyms 2-Amino-4-methoxycarbonylphenylboronic acid hydrochloride;Benzoicacid, 3-amino-4-borono-, 1-methyl ester, hydrochloride (9CI);2-Amino-4-(methoxycarbonyl)benzeneboronicacid hydrochloride;[2-Amino-4-(methoxycarbonyl)phenyl]boronic acidhydrochloride;
PSA 92.78000
LogP -0.68360

(2-Amino-4-methoxycarbonylphenyl)boronic acid hydrochloride Specification

The Benzoicacid, 3-amino-4-borono-, 1-methyl ester, hydrochloride (1:1), with the CAS registry number 380430-55-7, is also known as 2-Amino-4-methoxycarbonylphenylboronic acid hydrochloride. It belongs to the product categories of Boronicacid; Amines; Blocks; Boronic Acids; Carboxes. This chemical's molecular formula is C₈H₁₁BClNO₄ and molecular weight is 231.44124. Its IUPAC name is called (2-amino-4-methoxycarbonylphenyl)boronic acid hydrochloride.

Physical properties of Benzoicacid, 3-amino-4-borono-, 1-methyl ester, hydrochloride (1:1): (1)ACD/LogP: 0.38; (2)ACD/LogD (pH 5.5): 0.38; (3)ACD/LogD (pH 7.4): 0.18; (4)ACD/BCF (pH 5.5): 1.14; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 38.2; (7)ACD/KOC (pH 7.4): 24.1; (8)#H bond acceptors: 5; (9)#H bond donors: 4; (10)#Freely Rotating Bonds: 6; (11)Flash Point: 212.4 °C; (12)Enthalpy of Vaporization: 71.96 kJ/mol; (13)Boiling Point: 427.6 °C at 760 mmHg; (14)Vapour Pressure: 4.5E-08 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: B(C1=C(C=C(C=C1)C(=O)OC)N)(O)O.Cl
(2)InChI: InChI=1S/C8H10BNO4.ClH/c1-14-8(11)5-2-3-6(9(12)13)7(10)4-5;/h2-4,12-13H,10H2,1H3;1H
(3)InChIKey: IDUSDMZTKZZVAW-UHFFFAOYSA-N

Product Name

(2-Amino-4-methoxycarbonylphenyl)boronic acid hydrochloride

(2-Amino-4-methoxycarbonylphenyl)boronic acid hydrochloride Specification

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