CAS No.7399-67-9,2-(2-BROMOACETYL)BENZOIC ACID Suppliers

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Basic Information

Molecular Structure:
CAS No.:	7399-67-9
Name:	2-(2-BROMOACETYL)BENZOIC ACID
Article Data:	7

Formula:	C₉H₇BrO₃
Molecular Weight:	243.057
Synonyms:	2-(2-Bromoacetyl)benzoic acid;
Density:	1.657 g/cm³
Melting Point:	116-117 °C
Boiling Point:	366.5 °C at 760 mmHg
Flash Point:	175.4 °C
Risk Codes:	34
Safety:	26-36/37/39
Transport Information:	3261
PSA:	54.37000
LogP:	1.96240

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Specification

The Benzoic acid,2-(2-bromoacetyl)-, with the CAS registry number 7399-67-9, is also known as 2-(2-Bromoacetyl)benzoic acid. This chemical's molecular formula is C₉H₇BrO₃ and molecular weight is 243.05. What's more, its systematic name is called 2-(Bromoacetyl)benzoic acid.

Physical properties about Benzoic acid,2-(2-bromoacetyl)- are: (1)ACD/LogP: 1.34; (2)#of Rule of 5 Violations: 0; (3)ACD/BCF (pH 5.5): 1; (4)ACD/BCF (pH 7.4): 1; (5)ACD/KOC (pH 5.5): 1; (6)ACD/KOC (pH 7.4): 1; (7)#H bond acceptors: 3; (8)#H bond donors: 1; (9)#Freely Rotating Bonds: 3; (10)Polar Surface Area: 43.37 Å²; (11)Index of Refraction: 1.611; (12)Molar Refractivity: 50.94 cm³; (13)Molar Volume: 146.6 cm³; (14)Polarizability: 20.19×10^-24 cm³; (15)Surface Tension: 59.1 dyne/cm; (16)Density: 1.657 g/cm³; (17)Flash Point: 175.4 °C; (18)Enthalpy of Vaporization: 64.66 kJ/mol; (19)Boiling Point: 366.5 °C at 760 mmHg; (20)Vapour Pressure: 5.14E-06 mmHg at 25 °C; (21)Melting Point: 116-117 °C.

When you are dealing with this chemical, you should be very careful. This chemical will cause burns. Therefore, you should wear suitable protective clothing, gloves and eye/face protection. In case of contacting with eyes, you should rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
(1) SMILES: O=C(O)c1ccccc1C(=O)CBr
(2) InChI: InChI=1/C9H7BrO3/c10-5-8(11)6-3-1-2-4-7(6)9(12)13/h1-4H,5H2,(H,12,13)
(3) InChIKey: ZUXBPGMQEGEWHI-UHFFFAOYAI