AG008W7R

Name: 4-Mercaptomethyl Dipicolinic Acid (>90%)
Brand: Angene Chemical
SKU: AG008W7R

1040401-18-0 | 4-Mercaptomethyl Dipicolinic Acid (>90%)

AG008W7R

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CAS Number	1040401-18-0
Catalog Number	AG008W7R(AGN-PC-0WAG7G)
Chemical Name	4-Mercaptomethyl Dipicolinic Acid (>90%)
IUPAC Name	4-(sulfanylmethyl)pyridine-2,6-dicarboxylic acid
InChI	InChI=1S/C8H7NO4S/c10-7(11)5-1-4(3-14)2-6(9-5)8(12)13/h1-2,14H,3H2,(H,10,11)(H,12,13)
InChI Key	WSVZILXOOFJPGD-UHFFFAOYSA-N
MDL Number	MFCD16293855
Molecular Formula	C8H7NO4S
Molecular Weight	213.2105
SMILES	OC(=O)c1cc(CS)cc(n1)C(=O)O
Synonyms	4-Mercaptomethyl Dipicolinic Acid, 1040401-18-0, 4-(Mercaptomethyl)-2,6-pyridinedicarboxylic Acid, 4-MMDPA, DTXSID30857963, ZINC38665682, ACN-049033, FT-0671028, 4-(Mercaptomethyl)pyridine-2,6-dicarboxylic acid, 4-(Sulfanylmethyl)pyridine-2,6-dicarboxylic acid, J-001096,

Complexity	224
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	213.01g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	3
Isotope Atom Count	0
Molecular Weight	213.207g/mol
Monoisotopic Mass	213.01g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	88.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.7

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