Allophanic acid structure

Allophanic acid

carbamoylcarbamic acid

Also Known As: Allophanic acid|Allophanate|carbamoylcarbamic acid|allophanicacid|Allophansaeure|Allophansaure|Urea-1-carboxylate|urea-1-carboxylic acid|Carbamic acid, (aminocarbonyl)-|thiophanate-methyl TP|UREA, CARBOXY-|(aminocarbonyl)carbamic acid|Aminocarbonylcarbamic acid|UREACARBOXYLIC ACID|Thiophanate-methyl metabolite|Carbamicacid,(aminocarbonyl)-|CARBAMIC ACID, N-(AMINOCARBONYL)-

CAS: 51963-79-2
Molecular Formula C2H4N2O3
Molecular Weight 104.022194 g/mol
LogP -0.1
Topological Polar Surface Area 92.4 Ų
Hydrogen Bond Donors 3
Hydrogen Bond Acceptors 3
Rotatable Bonds 0
Exact Mass 104.022194
Monoisotopic Mass 104.022194
Heavy Atoms 7
Complexity 99.0

Chemical Identifiers

CAS Number 51963-79-2
SMILES C(=O)(N)NC(=O)O
InChIKey AVWRKZWQTYIKIY-UHFFFAOYSA-N

Patent-Derived Application Labels

Derived from 22 IPC patent classification(s) across the SureChEMBL global patent database.

Agrochemicals (81 patents) Analytical Reagents (19 patents) Biotechnology (49 patents) Catalysts (83 patents) Coatings & Adhesives (1651 patents) Construction Chemicals (54 patents) Dyes & Pigments (39 patents) Electronic Chemicals (36 patents) Food Additives (4 patents) Heterocyclic Building Blocks (318 patents) Lubricants & Additives (33 patents) Organic Building Blocks (873 patents) Organometallic Reagents (72 patents) Paper Chemicals (33 patents) Peptides & Amino Acids (16 patents) Pharmaceutical Intermediates (384 patents) Photographic Chemicals (190 patents) Plastic Additives (843 patents) Polymer Intermediates (9510 patents) Specialty Chemicals (186 patents) Surfactants & Detergents (47 patents) Textile Chemicals (240 patents)

Product Overview

Allophanic acid (CAS 51963-79-2), with molecular formula C2H4N2O3 and molecular weight 104.022194 g/mol. IUPAC: carbamoylcarbamic acid.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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