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165542-15-4

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165542-15-4 Structure

165542-15-4 Structure
IdentificationBack Directory
[Name]

HYDROXYECTOINE
[CAS]

165542-15-4
[Synonyms]

HYDROXYECTOINE
HYDROXYECTOIN*
Hydroxyectoine >=95% (HPLC)
(S)-5-Hydroxy-2-methyl-3,4,5,6-tetrahydro-pyrimidin-4-carbonsure
(4S,5S)-5-HYDROXY-2-METHYL-1,4,5,6-TETRAHYDROPYRIMIDINE-4-CARBOXYLIC ACID
(5S,6S)-5-hydroxy-2-methyl-1,4,5,6-tetrahydropyrimidine-6-carboxylic acid
4-Pyrimidinecarboxylic acid, 1,4,5,6-tetrahydro-5-hydroxy-2-methyl-, (4S,5S)-
4-Pyrimidinecarboxylicacid,1,4,5,6-tetrahydro-5-hydroxy-2-methyl-,(4S,5S)-(9CI)
THP(A), (4S,5S)-5-Hydroxy-2-methyl-1,4,5,6-tetrahydropyrimidine-4-carboxylic acid
[Molecular Formula]

C6H10N2O3
[MDL Number]

MFCD01863080
[MOL File]

165542-15-4.mol
[Molecular Weight]

158.16
Chemical PropertiesBack Directory
[Boiling point ]

465.2±45.0 °C(Predicted)
[density ]

1.56±0.1 g/cm3(Predicted)
[pka]

2.83±0.40(Predicted)
Safety DataBack Directory
[Symbol(GHS) ]


GHS07
[Signal word ]

Warning
[Hazard statements ]

H335-H319-H315
[Precautionary statements ]

P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
[Hazard Codes ]

Xi
[Risk Statements ]

36/37/38
[Safety Statements ]

26-36
[WGK Germany ]

1
[F ]

10
Hazard InformationBack Directory
[Definition]

ChEBI: 5-hydroxyectoine is a carboxamidine heterocycle which is obtained by formal condensation of 4-amino-L-allothreonine with acetic acid. It is a carboxamidine, a secondary alcohol, a member of 1,4,5,6-tetrahydropyrimidines and a monocarboxylic acid. It is a conjugate acid of a 5-hydroxyectoinate. It is a tautomer of a 5-hydroxyectoine zwitterion.
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