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CAS NO.7697-27-0
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2-Bromo-4-methylbenzoic acid Basic information |
Product Name: | 2-Bromo-4-methylbenzoic acid |
Synonyms: | RARECHEM AL BE 0916;2-BROMO-4-METHYLBENZOIC ACID;4-METHYL-2-BROMOBENZOIC ACID;3-Bromo-4-carboxytoluene;2-BroMo-4-Methylbenzoic Acid, 97+% |
CAS: | 7697-27-0 |
MF: | C8H7BrO2 |
MW: | 215.04 |
EINECS: | |
Product Categories: | C8;Carbonyl Compounds;Carboxylic Acids |
Mol File: | 7697-27-0.mol |
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2-Bromo-4-methylbenzoic acid Chemical Properties |
mp | 143-147 °C(lit.) |
CAS DataBase Reference | 7697-27-0(CAS DataBase Reference) |
Safety Information |
Hazard Codes | Xi |
Risk Statements | 36/37/38 |
Safety Statements | 26-36/37/39 |
WGK Germany | 3 |
HazardClass | IRRITANT |
Molecular Weight | 215.04398 g/mol |
---|---|
Molecular Formula | C8H7BrO2 |
XLogP3 | 3.5 |
Hydrogen Bond Donor Count | 1 |
Hydrogen Bond Acceptor Count | 2 |
Rotatable Bond Count | 1 |
Exact Mass | 213.962942 g/mol |
Monoisotopic Mass | 213.962942 g/mol |
Topological Polar Surface Area | 37.3 A^2 |
Heavy Atom Count | 11 |
Formal Charge | 0 |
Complexity | 158 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 0 |
Undefined Atom Stereocenter Count | 0 |
Defined Bond Stereocenter Count | 0 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 1 |