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[(3-Ammoniopropanoyl)amino]acetate

HCID 6992409
NotesReactions
Basic informationOverviewNames & identifiersPropertiesChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
2672-88-0
Standard SMILES
[NH3+]CCC(=O)NCC(=O)[O-]
InChIKey
QDHYJVJAGQLHBA-UHFFFAOYSA-N
Molecular formula
C5H10N2O3
Average molar mass
146.14 g/mol
Monoisotopic mass
146.06914219

Overview

See also: beta-Alanylglycine (preferred).

Names & identifiers

Preferred name
[(3-Ammoniopropanoyl)amino]acetate
IUPAC
2-(3-azaniumylpropanoylamino)acetate
English name
H-beta-Ala-Gly-OH
Molecular formula
C5H10N2O3
Molecular weight
146.14

Names & synonyms

CHEMBL157332[(3-ammoniopropanoyl)amino]acetateBDBM50137022beta-Ala-GlyB-ala-glyβ-Ala-GlyβAla-Gly-OHH-β-Ala-Gly-OHH-b-Ala-Gly-OHB-ALANYL GLYCINEN-β-AlanylglycineH-beta-Ala-Gly-OH
Show more names
ALPHA-ALANYLGLYCINE

Database identifiers

CAS
2672-88-0
PubChem CID
6992409
ChEMBL
CHEMBL157332

Properties

Computed structural properties

XLogP
-3.5
Topological polar surface area
96.9 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
3
Rotatable bonds
3
Heavy atoms
10
Formal charge
0
Complexity
129

Physicochemical properties

Melting point
230 °C · 230 °C
Boiling point
448.1 · 448.1±30.0 °C(Predicted)
Density
1.267 · 1.267±0.06 g/cm3(Predicted)
storage temp.
-15 °C · -15°C
pka
3.29 · 3.29±0.10(Predicted)

Chemistry & industry

Suppliers18 total

上海鸿肽生物科技有限公司15318089928 · [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]
凯试(上海)科技有限公司021-50135380 · [email protected]
NANJING YINGWEN BIOTECHNOLOGY CO LTD+8613382787392 · [email protected]
太原百利恒康生物技术有限公司19135651983 · [email protected]
杭州专肽生物技术有限公司17342063383 · [email protected]
南京肽谷生物科技有限公司18115476705 · [email protected]
成都云希化工有限公司+86-17380623303 · [email protected]
浙江杰坤生物科技有限公司15397062932 · [email protected]
上海瀚鸿科技股份有限公司021-54306202 18917919676 · [email protected]
ANHUI BYERSEN BIOTECH CO. LTD+8617355064950 · [email protected]
南京世洲生物科技有限公司13675144456 · [email protected]
南京肽研生物科技有限公司19961912513 19941518170 · [email protected]

Related reactions

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New reaction record

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Compound notes

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On this pageBasic informationOverviewNames & identifiersPropertiesChemistry & industryRelated reactionsCompound notes
DAYANG CHEM (HANGZHOU) CO.,LTD
+86-88938639 +86-17705817739 · [email protected]
Nanjing TGpeptide+86-13347807150 · [email protected]
宝鸡缔都医药化工有限公司029-029-81148929 17792602132 · [email protected]
绍兴市均宇生物科技有限公司0571-0571-88211921 19105816207 · [email protected]

Additional notes

DefinitionChEBI: A dipeptide formed from beta-alanine and glycine residues.