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erythro-3-Aminoaspartic acid

HCID 90033
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Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
23220-52-2
Standard SMILES
N[C@H](C(=O)O)[C@@H](N)C(=O)O
InChIKey
PGNYNCTUBKSHHL-XIXRPRMCSA-N
Molecular formula
C4H8N2O4
Average molar mass
148.12 g/mol
Monoisotopic mass
148.04840674

Names & identifiers

Preferred name
erythro-3-Aminoaspartic acid
IUPAC
(2R,3S)-2,3-diaminobutanedioic acid
English name
meso-2 3-Diaminosuccinic acid
Molecular formula
C4H8N2O4
Molecular weight
148.12

Names & synonyms

erythro-3-Aminoaspartic acidmeso-2,3-Diaminosuccinic acidEINECS 245-500-1DTXSID701307806RefChem:591113DTXCID601737733245-500-123220-52-2(2R,3S)-2,3-Diaminosuccinic acid(2R,3S)-2,3-diaminobutanedioic acid(3R)-3-Amino-L-aspartic acidMFCD00037765
Show more names
(2R,3S)-diaminosuccinic acid(2R,3S)-2,3-DiaminosuccinicaciMESO-2 3-DIAMINOSUCCINIC ACID USP/EP/BP
D-Aspartic acid, 3-amino-, (3S)-rel-50817-04-4SCHEMBL468084PGNYNCTUBKSHHL-XIXRPRMCSA-N(2R,3S)-2,3-DiaminosuccinicacidAKOS006339495AS-62657H42729

Database identifiers

CAS
23220-52-2
PubChem CID
90033
DTXSID
DTXSID701307806
EC Number
245-500-1
Nikkaji
J318.428E

Properties

Computed structural properties

XLogP
-7
Topological polar surface area
127 Ų
Hydrogen bond donors
4
Hydrogen bond acceptors
6
Rotatable bonds
3
Heavy atoms
10
Formal charge
0
Complexity
139

Physicochemical properties

Melting point
304 °C · 304 °C
Boiling point
304.7 · 304.7±42.0 °C(Predicted)
Density
1.611 · 1.611±0.06 g/cm3(Predicted)
form
powder
pka
1.43 · 1.43±0.27(Predicted)
color
white
Major Application
peptide synthesis
InChI
1S/C4H8N2O4/c5-1(3(7)8)2(6)4(9)10/h1-2H,5-6H2,(H,7,8)(H,9,10)/t1-,2+
InChIKey
PGNYNCTUBKSHHL-XIXRPRMCSA-N
SMILES
NC(C(N)C(O)=O)C(O)=O
UNSPSC Code
12352200 · 12352200
NACRES
22 · NA.22
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
315 · H315-H319-H335
Precautionary statements
261 · P261-P264-P271-P280-P302+P352-P305+P351+P338
target organs
Respiratory system
PPE
95 · dust mask type N95 (US), Eyeshields, Gloves
Hazard Codes
Xi
Risk Statements
36 · 36/37/38
Safety Statements
26 · 26-36
WGK Germany
3 · 3
HS Code
29214900 · 29214900
Storage Class
11 · 11 - Combustible Solids
Hazard Classifications
2 Skin · Eye Irrit. 2Skin Irrit. 2STOT SE 3

Safety & regulation

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

GHS classification

GHS Classification · 4 items

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 39 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard information

Hazard Classes and CategoriesSkin Irrit. 2 (100%)

Safety data

PPE
dust mask type N95 (US), Eyeshields, Gloves
wgk
3
hs_code
29214900
risk_code
36/37/38
Signal word
Warning
Symbol(GHS)
GHS07
hazard_code
Xi
safety_code
26-36
Storage Class
11 - Combustible Solids
target organs
Respiratory system
Hazard statements
H315-H319-H335
Hazard Classifications
Eye Irrit. 2Skin Irrit. 2STOT SE 3
Precautionary statements
P261-P264-P271-P280-P302+P352-P305+P351+P338

Chemistry & industry

Applications

Usesmeso-2,3-Diaminosuccinic Acid is used as a building block in organic synthesis. As well as used in the synthesis of metal complexes for antitumor activity.

Upstream & downstream products

Upstream raw materials

erythro-N-benzyl-3-(benzylamino)aspartic acidButanedioic acid, 2,2-dibromo-Acetic acid

Downstream products

DL-2,3-diaminosuccinic acid

Suppliers26 total

北京华美互利生物化工010-56205725 · [email protected]
毕佳索(上海毕得医药科技股份有限公司)400-6005915 · [email protected]
梯希爱(上海)化工贸易有限公司021-61109150 · [email protected]
上海瀚鸿科技股份有限公司021-54306202 13764082696 · [email protected]
山东西亚化学有限公司13355009207 13355009207 · [email protected]
泰州天鸿生化科技有限公司0523-86132544 15366717810 · [email protected]
上海鑫圭生物科技有限公司15121041756 · [email protected]
江苏艾康生物医药研发有限公司025-66028182 17714375163 · [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]
湖北恒绿源科技有限公司027-88188016 18717196322 · [email protected]
石家庄瑞田生化有限公司15831127780 · [email protected]
上海源叶生物科技有限公司18916372613 · [email protected]
成都华纯科技有限公司400-1166-196 15982826727 · [email protected]
湖北诺纳科技有限公司027-59209883 17386138556 · [email protected]
上海易恩化学技术有限公司400-400-1332688 18019345275 · [email protected]
河南天孚化工有限公司+86-0371-55170693 +86-19937530512 · [email protected]
济南药研药物化学有限公司[email protected]
南京美韬医药科技有限公司[email protected] · [email protected]
陕西缔都医药化工有限公司029-029-029-81148696 18161915376 · [email protected]
山东天铭生物科技发展有限责任公司400-9019001 400-901-9001
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
湖北诺纳科技有限公司027-59209883 17386169806 · [email protected]
湖北云镁科技有限公司027-59206672 18995657604 · [email protected]
Hefei TNJ Chemical Industry Co.,Ltd.+86-0551-65418671 +86-189 4982 3763 · [email protected]
武汉裕清嘉衡药业有限公司027-83855312 17771813295 13377865312 · [email protected]
Dideu Industries Group Limited+86-29-81148696 +86-15129568250 · [email protected]

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Compound notes

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