METHYL-3-BROMOBENZOATE, > 98%

Name: METHYL-3-BROMOBENZOATE
Brand: Chempure

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CAS Number

618-89-3

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IUPAC name	methyl 3-bromobenzoate
inchi	InChI=1S/C8H7BrO2/c1-11-8(10)6-3-2-4-7(9)5-6/h2-5H,1H3
inchi key	KMFJVYMFCAIRAN-UHFFFAOYSA-N
molecular formula	C8H7BrO2
synonyms	METHYL 3-BROMOBENZOATE 618-89-3 3-Bromobenzoic Acid Methyl Ester Methyl m-bromobenzoate Benzoic acid, 3-bromo-, methyl ester

Computed Properties

Molecular Weight:	215.04 g/mol
XLogP3:	2.9
Hydrogen Bond Donor Count:	0
Hydrogen Bond Acceptor Count:	2
Rotatable Bond Count:	2
Exact Mass:	213.96294 g/mol
Monoisotopic Mass:	213.96294 g/mol
Topological Polar Surface Area:	26.3 Å²
Heavy Atom Count:	11
Formal Charge:	0
Complexity:	147
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
Compound Is Canonicalized:	Yes

hazard signal	Warning
hazard classes and categories	Skin Irrit. 2 (66.7%) Eye Irrit. 2A (66.7%) STOT SE 3 (66.7%)
precautionary statement codes	P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501
hazard statements	H302 (33.3%): Harmful if swallowed [Warning Acute toxicity, oral] H312 (33.3%): Harmful in contact with skin [Warning Acute toxicity, dermal] H315 (66.7%): Causes skin irritation [Warning Skin corrosion/irritation] H319 (66.7%): Causes serious eye irritation [Warning Serious eye damage/eye irritation] H332 (33.3%): Harmful if inhaled [Warning Acute toxicity, inhalation] H335 (66.7%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
hazards summary	May cause irritation.

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*This document is like a lab demo—an example Certificate of Analysis (COA) that showcases what a COA looks like but may not match the latest batch in all its glory. Think of it as a chemistry experiment: close, but not quite the final reaction!

Product No: CJ8806

METHYL-3-BROMOBENZOATE, > 98%

Product No: CJ8806

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Product No: CJ8806

About this item

NAME AND IDENTIFIERS

CHEMICAL AND PHYSICAL PROPERTIES

SAFETY AND HAZARDS

Require a Sample Certificate of Analysis (COA) ?