Basic information
- CAS
1068-84-4- Standard SMILES
NC(C(=O)O)C(=O)O- InChIKey
JINBYESILADKFW-UHFFFAOYSA-N- Molecular formula
- C3H5NO4
- Average molar mass
- 119.08 g/mol
- Monoisotopic mass
- 119.02185764
Overview
Aminomalonic acid is an amino dicarboxylic acid that is malonic acid in which one of the methylene hydrogens has been replaced by an amino group. It has a role as a human metabolite and a Daphnia magna metabolite. It is functionally related to a malonic acid. It is a conjugate acid of an aminomalonate(1-).
Names & identifiers
- Preferred name
- Aminomalonic acid
- IUPAC
- 2-aminopropanedioic acid
- English name
- Aminomalonic acid
- Molecular formula
- C3H5NO4
- Molecular weight
- 119.08
Names & synonyms
Aminomalonic acid1068-84-42-Aminopropanedioic Acid2-Aminomalonic acid2-azaniumyl-3-hydroxy-3-oxopropanoateCHEBI:17475DTXSID50147777RefChem:557555DTXCID7070268AminomalonatePropanedioic acid, amino-aminopropanedioic acid
Show more names
JACS-1068-84-4aminomalonicaciP-585 cas#1068-84-42-aminopropanedioate2-azanylpropanedioic acidPropanedioic acid,2-amino-AMinoMalonic acid AMinoMalonic acid
Malonic acid, amino-alpha-Aminomalonic acidMFCD00673796C00872AminomalonicacidAminAminopropanedioateJINBYESILADKFW-UHFFFAOYSA-N
Database identifiers
- CAS
1068-84-4- PubChem CID
- 100714
- DTXSID
DTXSID50147777- ChEMBL
CHEMBL1232731- ChEBI
CHEBI:17475
Properties
Computed structural properties
- XLogP
- -3.6
- Topological polar surface area
- 101 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 8
- Formal charge
- 0
- Complexity
- 106
Experimental & physicochemical properties
DrugsPharmaceuticals -> Listed in ZINC15
Physical DescriptionSolid
Physicochemical properties
- Melting point
- 220 C · >220C (dec.)
- Boiling point
- 402.6 · 402.6±40.0 °C(Predicted)
- Density
- 1.67 · 1.67
- storage temp.
- Keep in dark place,Inert atmosphere,Room temperature
- solubility
- Water (Sparingly)
- form
- Solid
- pka
- 0.57 · 0.57±0.34(Predicted)
- color
- White to Off-White
- Stability
- Hygroscopic
Chemistry & industry
Applications
Uses2-Aminomalonic Acid can be used in biological study of novel amino acid and metabolomics signature in mice overexpressing muscle uncoupling protein 3.
Upstream & downstream products
Upstream raw materials
Suppliers88 total
北京华美互利生物化工010-56205725 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
南通飞宇生物科技有限公司0513-68819626 15152877458 · [email protected]
湖北万得化工有限公司15377098680 15377098680 · [email protected]
Hebei Chuanghai Biotechnology Co., Ltd+86-17732866630 · [email protected]
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]
成都彼样生物科技有限公司18108052721 · [email protected]
上海康恩博科技有限公司（科小研试剂）400-1388-521 17673770086 · [email protected]
陕西缔都化学有限公司029-029-81123119 17391733320 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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