AG00IGDJ

Name: Benzoic acid, 2-bromo-5-methyl-, methyl ester
Brand: Angene Chemical
SKU: AG00IGDJ

90971-88-3 | Benzoic acid, 2-bromo-5-methyl-, methyl ester

AG00IGDJ

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CAS Number	90971-88-3
Catalog Number	AG00IGDJ(AGN-PC-003SGY)
Chemical Name	Benzoic acid, 2-bromo-5-methyl-, methyl ester
EC Number	618-688-1
IUPAC Name	methyl 2-bromo-5-methylbenzoate
InChI	InChI=1S/C9H9BrO2/c1-6-3-4-8(10)7(5-6)9(11)12-2/h3-5H,1-2H3
InChI Key	PYRAZCQFEMNXJA-UHFFFAOYSA-N
MDL Number	MFCD00144764
Molecular Formula	C9H9BrO2
Molecular Weight	229.0706
SMILES	COC(=O)C1=C(Br)C=CC(C)=C1
Synonyms	METHYL 2-BROMO-5-METHYLBENZOATE, 90971-88-3, BENZOIC ACID, 2-BROMO-5-METHYL-, METHYL ESTER, 2-BROMO-5-METHYLBENZOIC ACID METHYL ESTER, 2-Bromo-5-methyl-benzoic acid methyl ester, ACMC-209r7r, SCHEMBL221754, CTK5G8701, KS-00000OYV, DTXSID10568368, methyl 2-bromo-5-methyl-benzoate, PYRAZCQFEMNXJA-UHFFFAOYSA-N, ZINC2516932, ANW-39541, MFCD00144764, AKOS015834891, AS03640, AJ-36995, AK-64919, CJ-08738, DA-17414, DS-15678, SC-51205, 2-Bromo-5-methylbenzoic acid, methyl ester, TR-028535, 2-Bromo-5-methyl- Benzoic acid methyl ester, CS-0046810, FT-0738454, ST24025222, V8956, B-4627, A1-00236, I01-10712, C9H9BrO2, Methyl2-bromo-5-methylbenzoate, ACN-045933,

Complexity	170
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	227.979g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	229.073g/mol
Monoisotopic Mass	227.979g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	26.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.8

CERTIFICATE OF ANALYSIS

Analysis Data:

Test:

Result:

Conclusion: The above product meets the specifications of Angene.

Analyst:Chase

Date:

Reviewed by:Jessie

Date:

Angene International Limited