Allylglucosinolate monohydrate

Catalog Number	ACM64550885
CAS Number	64550-88-5
Synonyms	Sinigrin monohydrate
Molecular Weight	358.4
InChI	InChI=1S/C10H17NO9S2/c1-2-3-6(11-20-22(16,17)18)21-10-9(15)8(14)7(13)5(4-12)19-10/h2,5,7-10,12-15H,1,3-4H2,(H,16,17,18)/p-1
InChI Key	PHZOWSSBXJXFOR-UHFFFAOYSA-M
Purity	95%+
Complexity	490
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Exact Mass	358.02664844
Heavy Atom Count	22
Hydrogen Bond Acceptor Count	11
Hydrogen Bond Donor Count	4
Monoisotopic Mass	358.02664844
PhysicalState	Powder
Rotatable Bond Count	6
Topological Polar Surface Area	203 Ų

Custom Q&A

What is the chemical name for SINIGRIN MONOHYDRATE?

SINIGRIN MONOHYDRATE is also known as Allylglucosinolate monohydrate.

What is the CAS number for SINIGRIN MONOHYDRATE?

The CAS number for SINIGRIN MONOHYDRATE is 64550-88-5.

What is the molecular formula of SINIGRIN MONOHYDRATE?

The molecular formula of SINIGRIN MONOHYDRATE is C10H18KNO10S2.

What is the melting point of SINIGRIN MONOHYDRATE?

The melting point of SINIGRIN MONOHYDRATE is 128 degrees Celsius (dec.) according to the reference.

What are the safety statements for SINIGRIN MONOHYDRATE?

The safety statements for SINIGRIN MONOHYDRATE are 24/25.

How should SINIGRIN MONOHYDRATE be stored?

SINIGRIN MONOHYDRATE should be stored in a hygroscopic, -20°C Freezer, under inert atmosphere.

What are the solubility properties of SINIGRIN MONOHYDRATE?

SINIGRIN MONOHYDRATE is slightly soluble in DMSO, Methanol, and Water.

What is the color of SINIGRIN MONOHYDRATE?

SINIGRIN MONOHYDRATE is described as White to Off-White in color.

How can sinigrin be purified?

Sinigrin can be purified by recrystallising it three times from EtOH and once from MeOH.

What is sinigrin used as a substrate for?

Sinigrin is a -D-thioglucopyranoside substrate for thioglucosidase.

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