Chlorogenic acid hemihydrate - ≥99%, high purity , CAS No.6001-76-9

Item Number

C274899

Grouped product items
SKU	Size	Availability	Price	Qty
C274899-250mg	250mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$38.90
C274899-1g	1g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$80.90

Antioxidant with a variety of biological effects

Basic Description

Synonyms	Chlorogenic acid hemihydrate\|6001-76-9\|CHLOROGENICACIDHEMIHYDRATE\|(1S,3R,4R,5R)-3-[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy-1,4,5-trihydroxycyclohexane-1-carboxylic acid;hydrate\|DTXSID80745381\|Chlorogenic acid hemihydrate, >=98.0% (T)\|(1S,3R,4R,5R)-3-{
Specifications & Purity	≥99%
Storage Temp	Store at 2-8°C
Shipped In	Wet ice
Product Description	Store at +4°C. The product can be stored for up to 12 months.

Names and Identifiers

IUPAC Name	(1S,3R,4R,5R)-3-[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy-1,4,5-trihydroxycyclohexane-1-carboxylic acid;hydrate
INCHI	InChI=1S/2C16H18O9.H2O/c217-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21;/h21-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23);1H2/b24-2+;/t211-,12-,14-,16+;/m11./s1
InChi Key	KMUJVRDSAIKKTF-MTDLMOCGSA-N
Canonical SMILES	C1C(C(C(CC1(C(=O)O)O)OC(=O)C=CC2=CC(=C(C=C2)O)O)O)O.C1C(C(C(CC1(C(=O)O)O)OC(=O)C=CC2=CC(=C(C=C2)O)O)O)O.O
Isomeric SMILES	C1[C@@](C[C@H]([C@@H]([C@@H]1O)O)OC(=O)/C=C/C2=CC(=C(C=C2)O)O)(O)C(=O)O.C1[C@@](C[C@H]([C@@H]([C@@H]1O)O)OC(=O)/C=C/C2=CC(=C(C=C2)O)O)(O)C(=O)O.O
PubChem CID	71306904
Molecular Weight	363.32

Solution Calculators

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Basic Description