AG003AIC

Name: 4,6-Dimethylisophthalic Acid
Brand: Angene Chemical
SKU: AG003AIC

2790-09-2 | 4,6-Dimethylisophthalic Acid

AG003AIC

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CAS Number	2790-09-2
Catalog Number	AG003AIC(AGN-PC-0JOUT2)
Chemical Name	4,6-Dimethylisophthalic Acid
IUPAC Name	4,6-dimethylbenzene-1,3-dicarboxylic acid
InChI	InChI=1S/C10H10O4/c1-5-3-6(2)8(10(13)14)4-7(5)9(11)12/h3-4H,1-2H3,(H,11,12)(H,13,14)
InChI Key	HAYIPGIFANTODX-UHFFFAOYSA-N
MDL Number	MFCD00230851
Molecular Formula	C10H10O4
Molecular Weight	194.1840
NSC Number	231476
SMILES	CC1=C(C=C(C(=O)O)C(=C1)C)C(=O)O
Synonyms	4,6-dimethylisophthalic acid, 2790-09-2, 4,6-dimethylbenzene-1,3-dicarboxylic acid, NSC231476, 4.6-Dimethylisophthalsaure, SCHEMBL69934, AC1L7P58, DTXSID20310734, ZINC1759739, MFCD00230851, AKOS004907101, NSC-231476, 4,6-Dimethyl-1,3-benzenedicarboxylic acid, D4377, CID314208,

Complexity	225
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	194.058g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	194.186g/mol
Monoisotopic Mass	194.058g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	74.6A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.7

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