1 2D Structure

2D Structure

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

copper;2-hydroxypropane-1,2,3-tricarboxylic acid

2.1.2 InChI

InChI=1S/C6H8O7.Cu/c7-3(8)1-6(13,5(11)12)2-4(9)10;/h13H,1-2H2,(H,7,8)(H,9,10)(H,11,12);/q;+2

2.1.3 InChI Key

QDUNDCWSEGVAAB-UHFFFAOYSA-N

2.1.4 Canonical SMILES

C(C(=O)O)C(CC(=O)O)(C(=O)O)O.[Cu+2]

2.2 Synonyms

2.2.1 Depositor-Supplied Synonyms

1. 10402-15-0

2. Copper;2-hydroxypropane-1,2,3-tricarboxylic Acid

3. Caswell No. 235b

4. Citric Acid, Copper Salt

5. Chelates Of Copper Citrate

6. Epa Pesticide Chemical Code 044005

7. 5153-00-4

2.3 Create Date

2005-08-08

3 Chemical and Physical Properties

Molecular Formula	C₆H₈CuO₇+₂
Molecular Weight	255.67 g/mol
Hydrogen Bond Donor Count	4
Hydrogen Bond Acceptor Count	7
Rotatable Bond Count	5
Exact Mass	254.956600 g/mol
Monoisotopic Mass	254.956600 g/mol
Topological Polar Surface Area	132 Å²
Heavy Atom Count	14
Formal Charge	2
Complexity	227
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently Bonded Unit Count	2

Copper Citrate