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Structure

(+)-Catechin hydrate

CAS
225937-10-0
Catalog Number
ACM225937100
Category
Other Products
Molecular Weight
308.28
Molecular Formula
C15H16O7

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Specification

Synonyms
(+)-3,3,4,5,7-FLAVANPENTOL HYDRATE;(+)-3,3,4,5,7-FLAVANPENTOL MONOHYDRATE;3,3,4,5,7-PENTAHYDROXYFLAVANE HYDRATE;(2R,3S)-2-(3,4-DIHYDROXYPHENYL)-3,4-DIHYDRO-1(2H)-BENZOPYRAN-3,5,7-TRIOL;(2R,3S)-2-(3,4-DIHYDROXYPHENYL)-3,4-DIHYDRO-1(2H)-BENZOPYRAN-3,5,7-TRIOL HYDRATE;2R-(3,4-DIHYDROXYPHENYL)-3,4-DIHYDRO-2H-1-BENZOPYRAN-3S,5,7-TRIOL, MONOHYDRATE;CATECHUIC ACID (HYDRATE);CATECHOL (FLAVAN), HYDRATE
Melting Point
175-177°C (anhydrous)(lit.)
Hazard Statements
Xi
Safety Description
26-36
Supplemental Hazard Statements
H315-H319-H335
Symbol
GHS07
What is the molecular formula of (+)-Catechin hydrate?

The molecular formula of (+)-Catechin hydrate is C15H16O7.

What is the molecular weight of (+)-Catechin hydrate?

The molecular weight of (+)-Catechin hydrate is 308.28 g/mol.

What is the IUPAC name of (+)-Catechin hydrate?

The IUPAC name of (+)-Catechin hydrate is (2R,3S)-2-(3,4-dihydroxyphenyl)-3,4-dihydro-2H-chromene-3,5,7-triol;hydrate.

What is the InChIKey of (+)-Catechin hydrate?

The InChIKey of (+)-Catechin hydrate is OFUMQWOJBVNKLR-NQQJLSKUSA-N.

How many hydrogen bond donor counts does (+)-Catechin hydrate have?

(+)-Catechin hydrate has 6 hydrogen bond donor counts.

What is the exact mass of (+)-Catechin hydrate?

The exact mass of (+)-Catechin hydrate is 308.08960285 g/mol.

How many hydrogen bond acceptor counts does (+)-Catechin hydrate have?

(+)-Catechin hydrate has 7 hydrogen bond acceptor counts.

What is the topological polar surface area of (+)-Catechin hydrate?

The topological polar surface area of (+)-Catechin hydrate is 111.2.

How many defined atom stereocenter counts does (+)-Catechin hydrate have?

(+)-Catechin hydrate has 2 defined atom stereocenter counts.

What is the complexity value of (+)-Catechin hydrate?

The complexity value of (+)-Catechin hydrate is 364.

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