CAS No.4073-35-2,3,5-DIBROMO-4-METHOXYBENZOIC ACID Suppliers

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Basic Information

Molecular Structure:
CAS No.:	4073-35-2
Name:	3,5-DIBROMO-4-METHOXYBENZOIC ACID
Article Data:	8

Formula:	C₈H₆Br₂O₃
Molecular Weight:	309.942
Synonyms:	p-Anisic acid, 3,5-dibromo- (6CI,7CI,8CI);3,5-Dibromo-4-methoxybenzoic acid;
Density:	1.957 g/cm³
Melting Point:	224 °C
Boiling Point:	365.2 °C at 760 mmHg
Flash Point:	174.7 °C
Hazard Symbols:	Xi
PSA:	46.53000
LogP:	2.91840

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Specification

This chemical is called Benzoic acid, 3,5-dibromo-4-methoxy-, and its CAS registry number is 4073-35-2. With the molecular formula of C₈H₆Br₂O₃, its molecular weight is 309.94. Additionally, its product categories are Aromatic Carboxylic Acids, Amides, Anilides, Anhydrides & Salts. This chemical should be stored in the cool and dry place.

Other characteristics of the Benzoic acid, 3,5-dibromo-4-methoxy- can be summarised as followings: (1)ACD/LogP: 3.15; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.35; (4)ACD/LogD (pH 7.4): 0.1; (5)ACD/BCF (pH 5.5): 2.32; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 19.63; (8)ACD/KOC (pH 7.4): 1.11; (9)#H bond acceptors: 3; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 35.53 Å²; (13)Index of Refraction: 1.614; (14)Molar Refractivity: 55.24 cm³; (15)Molar Volume: 158.3 cm³; (16)Polarizability: 21.89×10^-24cm³; (17)Surface Tension: 52.9 dyne/cm; (18)Density: 1.957 g/cm³; (19)Flash Point: 174.7 °C; (20)Enthalpy of Vaporization: 64.51 kJ/mol; (21)Boiling Point: 365.2 °C at 760 mmHg; (22)Vapour Pressure: 5.64E-06 mmHg at 25°C.

You can still convert the following datas into molecular structure:
1.SMILES: Brc1cc(cc(Br)c1OC)C(=O)O
2.InChI: InChI=1/C8H6Br2O3/c1-13-7-5(9)2-4(8(11)12)3-6(7)10/h2-3H,1H3,(H,11,12)
3.InChIKey: NAHPGFGVWWKSFU-UHFFFAOYAJ