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1,2-Benzenediol, 4-(2-amino-1-hydroxyethyl)-, (2R,3R)-2,3-dihydroxybutanedioate (1:1)

HCID 5813
NotesReactions
Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
3414-63-9
Standard SMILES
NCC(O)c1ccc(O)c(O)c1.O=C(O)[C@H](O)[C@@H](O)C(=O)O
InChIKey
WNPNNLQNNJQYFA-LREBCSMRSA-N
Molecular formula
C12H17NO9
Average molar mass
319.26 g/mol
Monoisotopic mass
319.09033112

Names & identifiers

Preferred name
1,2-Benzenediol, 4-(2-amino-1-hydroxyethyl)-, (2R,3R)-2,3-dihydroxybutanedioate (1:1)
IUPAC
4-(2-amino-1-hydroxyethyl)benzene-1,2-diol;(2R,3R)-2,3-dihydroxybutanedioic acid
English name
Norepinephrine tartrate
Molecular formula
C8H11NO3.C4H6O6
Molecular weight
319.27

Names & synonyms

1,2-Benzenediol, 4-(2-amino-1-hydroxyethyl)-, (2R,3R)-2,3-dihydroxybutanedioate (1:1)RefChem:411259(+/-)-Norepinephrine bitartrateDL-Norepinephrine (tartrate)1,2-Benzenediol, 4-(2-amino-1-hydroxyethyl)-,(2R,3R)-2,3-dihydroxybutanedioate (1:1) (salt)Norepinephrine tartrateNorepinephrine (tartrate)C12H17NO9Norepinephrine tartrate?Lopac0_000053orb1306464SCHEMBL30389831
Show more names
(2R,3R)-2,3-dihydroxysuccinatebutanedioate(1:1)(salt)(+-)-arterenolbitartrateNoradreniline Bitartrate(+/-)-Arterenolbitratrate(+-)-arterenol bitartratedl-noradrenalinebitartrate(±)-Norepinephrine bitartrate(+/-)-ARTERENOL BITARTRATE SALT
(y)-Norepinephrine (+)bitartrateWNPNNLQNNJQYFA-LREBCSMRSA-N(?)-Norepinephrine (+)bitartrateHMS3260K07Tox21_500053MFCD00132876AKOS015963988CCG-221357

Properties

Computed structural properties

Topological polar surface area
202 Ų
Hydrogen bond donors
8
Hydrogen bond acceptors
10
Rotatable bonds
5
Heavy atoms
22
Formal charge
0
Complexity
276

Physicochemical properties

Melting point
163 · 163-165 °C(Solv: methanol, 95% (67-56-1))
form
powder
color
White to off-white
InChI
InChI=1/C8H11NO3.C4H6O6/c9-4-8(12)5-1-2-6(10)7(11)3-5;5-1(3(7)8)2(6)4(9)10/h1-3,8,10-12H,4,9H2;1-2,5-6H,(H,7,8)(H,9,10)/t;1-,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 · 3414-63-9(CAS DataBase Reference)
FDA UNII
5 PE3ZRW · IFY5PE3ZRW
UNSPSC Code
12352200 · 12352200
NACRES
77 · NA.77
Symbol(GHS)
6 · GHS06
Signal word
Danger
Hazard statements
300 · H300+H310+H330
Precautionary statements
260 · P260-P262-P264-P280-P302+P352+P310-P304+P340+P310
PPE
3 · Eyeshields, Faceshields, Gloves, type P3 (EN 143) respirator cartridges

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

Safety data

PPE
Eyeshields, Faceshields, Gloves, type P3 (EN 143) respirator cartridges
wgk
3
rtecs
CZ8462500
ridadr
UN 2811 6.1/PG 2
Toxicity
LD50 ipr-mus: 31 mg/kg VHTODE 39,214,1997
risk_code
26/27/28
Signal word
Danger
Symbol(GHS)
GHS06
hazard_code
T+
safety_code
28-36/37-45
Storage Class
6.1B - Non-combustible acute toxic Cat. 1 and 2very toxic hazardous materials
Hazard statements
H300+H310+H330
REACH Registrations
Active
Hazard Classifications
Acute Tox. 1 InhalationAcute Tox. 2 DermalAcute Tox. 2 Oral
Precautionary statements
P260-P262-P264-P280-P302+P352+P310-P304+P340+P310

Chemistry & industry

Applications

Uses(+/-)-Norepinephrine (+)-Bitartrate Salt is an adrenergic neurotransmitter. Also, it reduces tracheal anaphylactic contractions.

Suppliers44 total

Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
Shenzhen Monkono Technology Co.,Ltd+86-17063441314 · [email protected]
武汉布林科技有限公司3456065315 13260619011 · [email protected]
杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [email protected]
江苏艾康生物医药研发有限公司025-025-66113011 15955137747 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
Sinco Pharmachem (ShenZhen) R&D Co., Ltd.+86-18603013401 · [email protected]
安耐吉化学&3A(安徽泽升科技有限公司)021-58432009 400-005-6266 · [email protected]
United Life Science020-82099279 18988968278 · [email protected]
佛山宝诺生物科技有限公司0757-85921206 18520245316 · [email protected]
杭州云易国科生物科技有限公司18457506494 · [email protected]
深圳菲斯生物科技有限公司

Related reactions

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Compound notes

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On this pageBasic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes

Database identifiers

CAS
3414-63-9
PubChem CID
5813
DTXSID
DTXSID401017232
Hazard Codes
T+
Risk Statements
26 · 26/27/28
Safety Statements
28 · 28-36/37-45
RIDADR
2811 · UN 2811 6.1/PG 2
WGK Germany
3 · 3
RTECS
8462500 · CZ8462500
Storage Class
6.1 B · 6.1B - Non-combustible acute toxic Cat. 1 and 2very toxic hazardous materials
Hazard Classifications
1 InhalationAcute · Acute Tox. 1 InhalationAcute Tox. 2 DermalAcute Tox. 2 Oral
Toxicity
50 ipr-mus: · LD50 ipr-mus: 31 mg/kg VHTODE 39,214,1997
REACH Registrations
Active
0755-83725350 13380397412 · [email protected]
四川省维克奇生物科技有限公司028-81700200 18116577057 · [email protected]
陕西缔都医药化工有限公司+86-029-81138252 +86-173 9270 1263 · [email protected]
天津普西唐生物医药科技有限公司010-60605840 · [email protected]
Sigma-Aldrich西格玛奥德里奇(上海)贸易有限公司021-61415566 800-8193336 · [email protected]
上海陶术生物科技股份有限公司+1-781-999-5354; +1-00000000000 · [email protected]
HANGZHOU LEAP CHEM CO., LTD.+86-571-87711850 +86-15355479329 · [email protected]
上海阿拉丁生化科技股份有限公司6206333 13167063860 · [email protected]
陕西缔都医药化工有限公司029-029-81120477 17792793610 · [email protected]
江西弗莱医药科技有限公司15870833005 · [email protected]
上海珞珐生化科技有限公司021-51111890 15317326293 · [email protected]
BOC Sciences16314854226 · [email protected]
上海源叶生物科技有限公司18916372613 · [email protected]
南京博米尔生物科技有限公司025-83453382-8005 · [email protected]
上海如吉生物科技发展有限公司021-69955236-807 13918189704 · [email protected]
上海跃腾生物技术有限公司021-36031160 13311776681 · [email protected]
杭州洁汉化工有限公司+86-571-86217390; +8618058761490 · [email protected]
厦门盈融达化工有限公司+86-0592-6210733 · [email protected]
新乡市奥兰生物科技有限公司0373-6766851 18568539857 · [email protected]
海蔚化学86-21-51086038 · [email protected]
Aladdin Scientific[email protected]
ANHUI WITOP BIOTECH CO., LTD+8618071025641 · [email protected]
XIAMEN AMITY INDUSTRY AND TRADE CO., LTD.+8618950047208 · [email protected]
TargetMol中国(陶术生物)4008200310 15002144251 · [email protected]
BOC Sciences+1-631-485-4226 · [email protected]
重庆卡兰医药有限公司[email protected]
南京世洲生物科技有限公司025-85560043 15850508050 · [email protected]
上海阿摩尔生物科技有限公司13370042665 18916960931 · [email protected]
AFINE CHEMICALS LIMITED+86-571-85134551 +86-18958018566 · [email protected]
上海禾午生物科技有限公司021-57886085 17317861055 · [email protected]
InvivoChem+1-708-310-1919 +1-13798911105 · [email protected]
上海博拓生物科技有限公司16621358918 · [email protected]
DONBOO AMINO ACID COMPANY13063595538 · [email protected]