HuagongsheHuagongshe Chemistry Print Report · For research reference only
1,2-Benzenediol, 4-(2-amino-1-hydroxyethyl)-, (2R,3R)-2,3-dihydroxybutanedioate (1:1)
(2R,3R)-2,3-dihydroxysuccinate · butanedioate(1:1)(salt) · Norepinephrine tartrate · (+-)-arterenolbitartrate · Noradreniline Bitartrate · (+/-)-Arterenolbitratrate · (+-)-arterenol bitartrate · dl-noradrenalinebitartrate
Identifiers & Physical Properties
| CAS No. | 3414-63-9 |
|---|---|
| Molecular formula | C12H17NO9 |
| Average molar mass | 319.26 g/mol |
| Monoisotopic mass | 319.09033112 g/mol |
| SMILES | NCC(O)c1ccc(O)c(O)c1.O=C(O)[C@H](O)[C@@H](O)C(=O)O |
| InChIKey | WNPNNLQNNJQYFA-LREBCSMRSA-N |
| PubChem CID | 5813 |
| DTXSID | DTXSID401017232 |
Chemical & Physical Properties
| Topological polar surface area | 202 |
|---|---|
| Hydrogen bond donors | 8 |
| Hydrogen bond acceptors | 10 |
| Rotatable bonds | 5 |
| Heavy atoms | 22 |
| Formal charge | 0 |
| Complexity | 276 |
| Melting point | 163-165 °C(Solv: methanol, 95% (67-56-1)) |
| Physical state | powder |
| Color | White to off-white |
| InChI | InChI=1/C8H11NO3.C4H6O6/c9-4-8(12)5-1-2-6(10)7(11)3-55-1(3(7)8)2(6)4(9)10/h1-3,8,10-12H,4,9H21-2,5-6H,(H,7,8)(H,9,10)/t1-,2-/s3 |
| InChIKey | WNPNNLQNNJQYFA-MVELKYERNA-N |
| SMILES | C1(C(O)CN)=CC=C(O)C(O)=C1.[C@H](O)(C(=O)O)[C@@H](O)C(=O)O |&1:12,17,r| |
| CAS DataBase Reference | 3414-63-9(CAS DataBase Reference) |
| FDA UNII | IFY5PE3ZRW |
| UNSPSC Code | 12352200 |
| NACRES | NA.77 |
| GHS pictogram | GHS06 |
| Signal word | Danger |
| GHS hazard statements | H300+H310+H330 |
| GHS precautionary statements | P260-P262-P264-P280-P302+P352+P310-P304+P340+P310 |
| Personal protective equipment (PPE) | Eyeshields, Faceshields, Gloves, type P3 (EN 143) respirator cartridges |
| Hazard symbols | T+ |
| Risk statements (R) | 26/27/28 |
| Safety statements (S) | 28-36/37-45 |
| UN transport number | UN 2811 6.1/PG 2 |
| Water hazard class (WGK) | 3 |
| RTECS number | CZ8462500 |
| Storage class | 6.1B - Non-combustible acute toxic Cat. 1 and 2very toxic hazardous materials |
| Hazard class | Acute Tox. 1 InhalationAcute Tox. 2 DermalAcute Tox. 2 Oral |
| Toxicity | LD50 ipr-mus: 31 mg/kg VHTODE 39,214,1997 |
| REACH registrations | Active |
Safety & Regulations
| Personal protective equipment (PPE) | Eyeshields, Faceshields, Gloves, type P3 (EN 143) respirator cartridges |
|---|---|
| Water hazard class (WGK) | 3 |
| RTECS number | CZ8462500 |
| UN transport number | UN 2811 6.1/PG 2 |
| Toxicity | LD50 ipr-mus: 31 mg/kg VHTODE 39,214,1997 |
| Risk statements (R) | 26/27/28 |
| Signal word | Danger |
| GHS pictogram | GHS06 |
| Hazard symbols | T+ |
| Safety statements (S) | 28-36/37-45 |
| Storage class | 6.1B - Non-combustible acute toxic Cat. 1 and 2very toxic hazardous materials |
| GHS hazard statements | H300+H310+H330 |
| REACH registrations | Active |
| Hazard class | Acute Tox. 1 InhalationAcute Tox. 2 DermalAcute Tox. 2 Oral |
| GHS precautionary statements | P260-P262-P264-P280-P302+P352+P310-P304+P340+P310 |
Applications & Uses
Uses
(+/-)-Norepinephrine (+)-Bitartrate Salt is an adrenergic neurotransmitter. Also, it reduces tracheal anaphylactic contractions.