AG01B6PW

Name: 3-Bromo-2,4,6-trimethylbenzoic acid
Brand: Angene Chemical
SKU: AG01B6PW

5333-13-1 | 3-Bromo-2,4,6-trimethylbenzoic acid

AG01B6PW

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CAS Number	5333-13-1
Catalog Number	AG01B6PW(AGN-PC-0JN9J8)
Chemical Name	3-Bromo-2,4,6-trimethylbenzoic acid
IUPAC Name	3-bromo-2,4,6-trimethylbenzoic acid
InChI	InChI=1S/C10H11BrO2/c1-5-4-6(2)9(11)7(3)8(5)10(12)13/h4H,1-3H3,(H,12,13)
InChI Key	VUVHCRZIUORPEG-UHFFFAOYSA-N
MDL Number	MFCD24107207
Molecular Formula	C10H11BrO2
Molecular Weight	243.0971
NSC Number	601
SMILES	c1(c(cc(c(c1C)C(=O)O)C)C)Br
Synonyms	3-bromo-2,4,6-trimethylbenzoic acid, 5333-13-1, NSC601, AC1L56NO, AC1Q25FB, 3-Bromo-beta-isodurylic acid, SCHEMBL8730406, CTK4J7619, DTXSID50277063, NSC-601, .beta.-Isodurylic acid, 3-bromo-, ZINC1596365, AKOS020008195, 3-bromo-2,4,6-trimethyl-benzoic acid, Benzoic acid, 3-bromo-2,4, 6-trimethyl-, Z2692095097, Benzoic acid,4,6-trimethyl-, AR-1F2194, CID219380, Benzoic acid, 3-bromo-2,4,6-trimethyl-, 58177-53-0,

Complexity	205
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	241.994g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	243.1g/mol
Monoisotopic Mass	241.994g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	37.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.2

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