ECTOINE CAS#: 96702-03-3; ChemWhat Code: 12275

IdentificationPhysical DataSpectra
Route of Synthesis (ROS)Safety and HazardsOther Data

Identification

Product NameECTOINE
IUPAC Name(6S)-2-methyl-1,4,5,6-tetrahydropyrimidine-6-carboxylic acid
Molecular StructureECTOINE-CAS-96702-03-3
CAS Registry Number 96702-03-3
MDL NumberMFCD16621117
Synonymsectoine
96702-03-3
L-Ectoine
(S)-2-Methyl-3,4,5,6-tetrahydropyrimidine-4-carboxylic acid
Thp(B)
(S)-2-Methyl-1,4,5,6-tetrahydropyrimidine-4-carboxylic acid
7GXZ3858RY
CHEBI:27592
(4S)-2-methyl-1,4,5,6-tetrahydropyrimidine-4-carboxylic acid
(6S)-2-methyl-1,4,5,6-tetrahydropyrimidine-6-carboxylic acid
4-Pyrimidinecarboxylicacid, 3,4,5,6-tetrahydro-2-methyl-, (4S)-
ectoin
(S)-2-Methyl- 1,4,5,6-tetrahydropyrimidine-4-carboxylic acid
(+)-1,4,5,6-tetrahydro-2-methyl-4-pyrimidinecarboxylic acid
UNII-7GXZ3858RY
SMR000127407
Ectoine, primary pharmaceutical reference standard
Ectoine?
MFCD03419286
NSC-614616
(4S)-2-methyl-1,4,5,6-tetrahydropyrimidine-4-carboxylate
4CS
Ectoine, osmoprotectant
ECTOIN [INCI]
ECTOINE [MI]
ECTOINE [WHO-DD]
SCHEMBL93532
US9138393, Ectoine
US9144538, Ectoine
MLS001332487
MLS001332488
CHEMBL1230264
DTXSID50869280
BDBM181140
Ectoine, >=95.0% (HPLC)
(4S)-3,4,5,6-Tetrahydro-2-methyl-4-pyrimidinecarboxylic acid
EX-A1678
4-Pyrimidinecarboxylic acid, 1,4,5,6-tetrahydro-2-methyl-, (4S)-
s5591
AKOS006348056
AKOS027427031
CCG-266161
DS-3343
NSC 614616
AC-33942
HY-107784
CS-0030647
E1372
NS00077626
C06231
I11596
Q414414
(S)-1,4,5,6-tetrahydro-2-methyl-4-pyrimi-dinecarboxylic acid
(s)-1,4,5,6-tetrahydro-2-methyl-4-pyrimidinecarboxylic acid
(S)-2-Methyl-3,4,5,6-tetrahydropyrimidine-4 carboxylic acid
(6S)-2-methyl-1,4,5,6-tetrahydropyrimidin-3-ium-6-carboxylate
4-Pyrimidinecarboxylic acid, 1,4,5,6-tetrahydro-2-methyl-, (+)-
Ectoine (2-Methyl-1,4,5,6-tetrahydropyrimidine-4-carboxylic acid)
Molecular FormulaC6H10N2O2 
Molecular Weight142.16
InChIInChI=1S/C6H10N2O2/c1-4-7-3-2-5(8-4)6(9)10/h5H,2-3H2,1H3,(H,7,8)(H,9,10)/t5-/m0/s1
InChI KeyCWQXNXVUDBPYKBA-YFKPBYRVSA-N
Isomeric SMILESCC1=NCC[C@H](N1)C(=O)O

Physical Data

AppearanceWhite powder

Spectra

No data available

Route of Synthesis (ROS)

No data available

Safety and Hazards

GHS Hazard Statements
Not Classified

Other Data

Under the room temperature and away from light
HS Code
StorageUnder the room temperature and away from light
Shelf Life2 years
Market Price
Use Pattern
ECTOINE CAS 778571-57-6 is a commonly used food additive with various applications in the industrial, agricultural, and feed industries. It serves as a plant nutrient supplement, providing magnesium for plant absorption, thereby promoting plant growth and development. It is also utilized as a food additive.

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Ulcho Biochemical Limitedhttp://www.ulcho.com/
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