Citric Acid Monohydrate

CAT: 1489-C9861-01Size: 500 gDry Ice: NoHazardous: No

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CAT#:1489-C9861-01Size:500 g

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CAS Number

5949-29-1

Purity

≥99.5%

Chemical Information

2-Hydroxy-1,2,3-propanetricarboxylic acid hydrate (1:1)

Citric acid monohydrate is an organic molecular entity.

CAS Number	5949-29-1
PubChem CID	22230
IUPAC Name	2-hydroxypropane-1,2,3-tricarboxylic acid;hydrate
Molecular Formula	C6H10O8
Molecular Weight	210.14
Topological Polar Surface Area	133
Hydrogen Bond Donor Count	5
Hydrogen Bond Acceptor Count	8
Rotatable Bond Count	5
Heavy Atom Count	14
Formal Charge	0
Complexity	227

SMILES

C(C(=O)O)C(CC(=O)O)(C(=O)O)O.O

InChI

InChI=1S/C6H8O7.H2O/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);1H2

InChIKey

YASYEJJMZJALEJ-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 5949-29-1

CID: 22230

Formula: C6H10O8

MW: 210.14

Interactive 3D Structure

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Computed Properties

Property	Value
Molecular Weight	210.14
Hydrogen Bond Donor Count	5
Hydrogen Bond Acceptor Count	8
Rotatable Bond Count	5
Exact Mass	210.03756727
Monoisotopic Mass	210.03756727
Topological Polar Surface Area	133 Å²
Heavy Atom Count	14
Formal Charge	0
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
Compound Is Canonicalized	Yes

Catalog	Name
C8610	Citric Acid (Anhydrous)
C8611	Citric Acid Anhydrous 99.5%
G2480	Formate-Citric Acid Decalcifying Solution
Z2180	Zoledronic Acid Monohydrate
G9560	Gallic Acid Monohydrate
M8011-01	MES (Free Acid, Monohydrate)
M8010-01	MES, Free Acid, Monohydrate
G8120-01	D- (+) -Galacturonic Acid Monohydrate
I8640-01	Citric Acid Iron (III) Salt Ferric Citrate
G1074	Crystal Violet - Citric Acid Stain Solution, 0.1%