Ectoine 96702-03-3 98.00%
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Post Date:
Feb 10,2017
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Expiry Date:
Feb 10,2018
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Detailed Description:
Cas No. :96702-03-3
Quantity: 25Kilograms
Specs:98.00%
Payment Method: one week after payment
【Density】
1.37g/cm3
【Boiling Point】
381.5°Cat760mmHg
【Refractive Index】
1.596
【Flash Point】
184.5°C
【Computed Properties】
Molecular Weight:142.1558 [g/mol]
Molecular Formula:C6H10N2O2
XLogP3-AA:-0.8
H-Bond Donor:2
H-Bond Acceptor:3
Rotatable Bond Count:1
Tautomer Count:2
Exact Mass:142.074228
MonoIsotopic Mass:142.074228
Topological Polar Surface Area:61.7
Heavy Atom Count:10
Formal Charge:0
Complexity:177
Isotope Atom Count:0
Defined Atom Stereocenter Count:1
Undefined Atom Stereocenter Count:0
Defined Bond Stereocenter Count:0
Undefined Bond Stereocenter Count:0
Covalently-Bonded Unit Count:1
Feature 3D Acceptor Count:2
Feature 3D Donor Count:1
Feature 3D Anion Count:1
Feature 3D Cation Count:1
Feature 3D Ring Count:1
Effective Rotor Count:1.8
Conformer Sampling RMSD:0.4
CID Conformer Count:6
Safety and Handling
【Hazard Codes】
Xi: Irritant;
【Risk Statements】
R36/37/38
【Safety Statements 】
S26;S37/39
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CAS Registry Number:
96702-03-3
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Synonyms:
;1,4,5,6-Tetrahydro-2-methyl-4-pyrimidinecarboxylic acid;2-Methyl-1,4,5,6-tetrahydropyrimidine-4-carboxylic acid; 4-Pyrimidinecarboxylic acid, 1,4,5,6-tetrahydro-2-methyl-,
(+)-;(S)-2-Methyl-1,4,5,6-tetrahydropyrimidine-4-carboxylic acid sodium salt monohydrate;
;(4S)-2-methyl-3,4,5,6-tetrahydropyrimidine-4-carboxylic acid;Ectoin;
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Molecular Formula:
C6H10N2O2
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Molecular Weight:
142.1558
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Molecular Structure:
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Hazard Symbols:
Xi:Irritant;
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Risk Codes:
R36/37/38:Irritating to eyes, respiratory system and skin.;
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Safety Description:
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.;
S37/39:Wear suitable gloves and eye/face protection.;
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