AG0034IS

4371-28-2 | Biphenyl-3,3,5,5-tetracarboxylic acid

AG0034IS

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CAS Number	4371-28-2
Catalog Number	AG0034IS(AGN-PC-0NL066)
Chemical Name	Biphenyl-3,3,5,5-tetracarboxylic acid
IUPAC Name	5-(3,5-dicarboxyphenyl)benzene-1,3-dicarboxylic acid
InChI	InChI=1S/C16H10O8/c17-13(18)9-1-7(2-10(5-9)14(19)20)8-3-11(15(21)22)6-12(4-8)16(23)24/h1-6H,(H,17,18)(H,19,20)(H,21,22)(H,23,24)
InChI Key	QURGMSIQFRADOZ-UHFFFAOYSA-N
MDL Number	MFCD16621475
Molecular Formula	C16H10O8
Molecular Weight	330.2458
SMILES	O=C(O)c1cc(cc(c1)c2cc(cc(c2)C(=O)O)C(=O)O)C(=O)O
Synonyms	4371-28-2, Biphenyl-3,3',5,5'-tetracarboxylic acid, [1,1'-Biphenyl]-3,3',5,5'-tetracarboxylic acid, Biphenyl-3,3,5,5-tetracarboxylic acid, [1,1'-biphenyl]3,3',5,5'-tetracarboxylic acid, [1,1 -biphenyl]3,3 ,5,5 -tetracarboxylic acid, PubChem20536, 5,5'-Bi[isophthalic acid], KSC496E1J, SCHEMBL145349, CTK3J6214, KS-00000RNV, DTXSID60578790, 3574AE, BBL101785, MFCD16621475, STL555582, ZINC34751368, AKOS007930836, DS-5378, ML01022, 3,3',5,5'-Blphenyltetracarboxylic acid, AJ-90063, AK136316, AB0065240, AX8257884, RT-002908, B3792, Z-1952, [1,1'-biphenyl]-3,3',5,5'-tetracarboxylicacid, 5-(3,5-dicarboxyphenyl)benzene-1,3-dicarboxylic acid, C16H10O8, Biphenyl-3,3',5,5'-tetracarboxylic acid, 99% - 200MG 200mg,

Complexity	450
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	330.038g/mol
Formal Charge	0
Heavy Atom Count	24
Hydrogen Bond Acceptor Count	8
Hydrogen Bond Donor Count	4
Isotope Atom Count	0
Molecular Weight	330.248g/mol
Monoisotopic Mass	330.038g/mol
Rotatable Bond Count	5
Topological Polar Surface Area	149A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.7

GHS Hazard and Precautionary Statements

Symbol:
Hazard statements	H315-H319
Precuationary statements	P305+P351+P338
Siginal words

Certificate of Analysis

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