AG00IA9Z

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CAS Number	57711-73-6
Catalog Number	AG00IA9Z(AGN-PC-0JQJN5)
Chemical Name	2-Cyano-3-(4-dimethylamino-phenyl)-acrylic acid
IUPAC Name	2-cyano-3-[4-(dimethylamino)phenyl]prop-2-enoic acid
InChI	InChI=1S/C12H12N2O2/c1-14(2)11-5-3-9(4-6-11)7-10(8-13)12(15)16/h3-7H,1-2H3,(H,15,16)
InChI Key	CXZXLLVNQYUMAW-UHFFFAOYSA-N
MDL Number	MFCD00453346
Molecular Formula	C12H12N2O2
Molecular Weight	216.2359
SMILES	O=C(O)/C(C#N)=C/C1=CC=C(N(C)C)C=C1
Synonyms	57711-73-6, 2-Propenoic acid, 2-cyano-3-[4-(dimethylamino)phenyl]-, 2-Cyano-3-(4-(dimethylamino)phenyl)acrylic acid, 2-cyano-3-[4-(dimethylamino)phenyl]prop-2-enoic acid, AC1L7W0A, CTK1F1455, CTK8F4222, DTXSID90327233, CXZXLLVNQYUMAW-UHFFFAOYSA-N, AKOS034343851, MCULE-7510450394, 2-cyano-3-(4-dimethylaminophenyl)-2-propenoic acid, 2-cyano-3-(4-dimethylaminophenyl)prop-2-enoic acid, Z44303383, CID367933, NSC638132, 2-Cyano-3-(4-dimethylamino-phenyl)-acrylic acid,

Complexity	330
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	216.09g/mol
Formal Charge	0
Heavy Atom Count	16
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	216.24g/mol
Monoisotopic Mass	216.09g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	64.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	1
XLogP3	1.9

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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