(-)-(R)-Adrenaline hydrogenated tartrate monohydrate

Structural formula

Business number	014R
Molecular formula	C12H17NO9
Molecular weight	319.27
label	L-Norepinephrine Bitartrate, L-Norepinephrine Bitartrate, C8H11NO3·C4H6O6

Numbering system

CAS number:51-40-1

MDL number:None

EINECS number:None

RTECS number:None

BRN number:None

PubChem ID:None

Physical property data

None

Toxicological data

1, acute toxicity: rat subcutaneous LD50: 3987 ug/kg; rat intravenous LD50: 210 ug/kg; mouse abdominal cavity LD50: 26800ug/kg; mouse vein LD50: 1025ug/kg;

2, mutagenicity: somatic mutation in mammals cellsTEST system: rodents – mouse lymphocytes: 100mg/L

Ecological data

None

Molecular structure data

None

Compute chemical data

1. Reference value for hydrophobic parameter calculation (XlogP):

2. Number of hydrogen bond donors: 8

3. Number of hydrogen bond acceptors: 10

4. Number of rotatable chemical bonds: 5

5. Number of tautomers: 10

6. Topological molecular polar surface area (TPSA):202

7. Number of heavy atoms: 22

8. Surface charge: 0

9. Complexity: 276

10. Number of isotope atoms: 0

11. Determine the number of atomic stereocenters: 0

12. The number of uncertain atomic stereocenters: 3

13. Determine the number of stereocenters of chemical bonds: 0

14. Uncertain number of chemical bond stereocenters: 0

15. Number of covalent bond units: 2

Properties and stability

None

Storage method

None

Synthesis method

None

Purpose

None