AG0033IW

490-11-9 | 3,4-Pyridinedicarboxylic Acid

AG0033IW

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CAS Number	490-11-9
Catalog Number	AG0033IW(AGN-PC-0JK9H9)
Chemical Name	3,4-Pyridinedicarboxylic Acid
EC Number	207-705-4
IUPAC Name	pyridine-3,4-dicarboxylic acid
InChI	InChI=1S/C7H5NO4/c9-6(10)4-1-2-8-3-5(4)7(11)12/h1-3H,(H,9,10)(H,11,12)
InChI Key	MUYSADWCWFFZKR-UHFFFAOYSA-N
MDL Number	MFCD00006392
Molecular Formula	C7H5NO4
Molecular Weight	167.1189
NSC Number	178
SMILES	O=C(O)c1cnccc1(C(=O)O)
UNII	7389UZW5DY
Synonyms	3,4-pyridinedicarboxylic acid, Pyridine-3,4-dicarboxylic acid, 490-11-9, 3,4-Pyridinedicarboxylic acid, CINCHOMERONIC ACID, Chinchomeronic acid, Pyridine-3,4-dicarboxylicacid, 3,4-Pyridinedicarboxylicacid, UNII-7389UZW5DY, MFCD00006392, 7389UZW5DY, CHEBI:46860, MUYSADWCWFFZKR-UHFFFAOYSA-N, 3,4-Pyridinedicarboxylic acid, 97%, 3,4-pyridindicarbons, Cinchomeronsaure, NSC 178, EINECS 207-705-4, PubChem2419, 3,4-Dicarboxypyridine, ACMC-1AQEQ, AC1L1UUQ, pyridine carboxylate, 6e, AC1Q1I9S, Cambridge id 5153935, Oprea1_020498, SCHEMBL71335, KSC237C4H, TPC-PY060, 3,4-pyridine dicarboxylic acid, 3,4-pyridine-dicarboxylic acid, CHEMBL261326, NSC178, pyridine 3,4-dicarboxylic acid, BDBM26117, CTK1D7143, 2,3-Pyridinedicarboxylic acid #, DTXSID70197653, NSC-178, ZINC105344, ACT05497, CS-D1674, KS-000004YQ, STR01772, ANW-30722, BBL010076, CL0113, FC0278, RW3000, SBB028479, STK801438, AKOS000280879, AC-1183, AM62714, AN-4623, FG-0458, LS20440, MCULE-9167973257, QC-2428, RP02506, RTR-032846, TRA0030812, AJ-11201, AK-46120, BC212242, BP-21355, BR-46120, SC-04791, SY004289, AB0006587, AB1000070, DB-028271, ST2419821, TR-032846, FT-0623820, P0682, ST50307918, MFCD00006392 (97%), C-4578, 490P119, Q-101246, F0001-1280, Z1270443863, InChI=1/C7H5NO4/c9-6(10)4-1-2-8-3-5(4)7(11)12/h1-3H,(H,9,10)(H,11,12, C7H5NO4, C7-H5-N-O4, CID10273, AR-1E9338, ACN-029629, CB10042, 3,4-Pyridinedicarboxylic acid, 98% - 25G 25g, 514-05-6,

Complexity	204
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	167.022g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	167.12g/mol
Monoisotopic Mass	167.022g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	87.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	-0.1

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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