Record Information
Version1.0
Creation date2015-10-09 22:30:53 UTC
Update date2017-01-19 02:36:25 UTC
FoodComEx IDPC000487
FoodDB RecordNot Available
Chemical Information
Name1-Aminocyclopropanecarboxylic acid
DescriptionIsolated from apple and pear juice and cranberries. 1-Aminocyclopropanecarboxylic acid is found in many foods, some of which are chinese cabbage, garden tomato, rye, and tea.
CAS Number22059-21-8
Structure
Thumb
Synonyms
SynonymSource
α-aminocyclopropane carboxylic acidbiospider
1-Amino-1-carboxycyclopropanebiospider
1-amino-Cyclopropanecarboxylic acidHMDB
1-Aminocyclopropane-1-1-carboxylic acidHMDB
1-AMINOCYCLOPROPANE-1-1CARBOXYLIUC ACIDbiospider
1-Aminocyclopropane-1-carboxylatebiospider
1-Aminocyclopropane-1-carboxylic acidbiospider
1-AMINOCYCLOPROPANECARBOXYLateGenerator
1-Aminocyclopropanecarboxylic acid hydrochloridebiospider
ACCbiospider
ACPCbiospider
Alpha-aminocyclopropane carboxylic acidbiospider
Alpha-aminocyclopropanecarboxylic acidbiospider
Aminocyclopropane carboxylic acidbiospider
Cyclopropanecarboxylic acid, 1-amino-biospider
Chemical FormulaNot Available
IUPAC nameNot Available
InChI IdentifierInChI=1S/C4H7NO2/c5-4(1-2-4)3(6)7/h1-2,5H2,(H,6,7)
InChI KeyPAJPWUMXBYXFCZ-UHFFFAOYSA-N
Isomeric SMILESNC1(CC1)C(O)=O
Average Molecular Weight101.1039
Monoisotopic Molecular Weight101.047678473
Chemical Taxonomy
Description Belongs to the class of organic compounds known as alpha amino acids. These are amino acids in which the amino group is attached to the carbon atom immediately adjacent to the carboxylate group (alpha carbon).
KingdomOrganic compounds
Super ClassOrganic acids and derivatives
ClassCarboxylic acids and derivatives
Sub ClassAmino acids, peptides, and analogues
Direct ParentAlpha amino acids
Alternative Parents
Substituents
  • Alpha-amino acid
  • 1-aminocyclopropane-1-carboxylic acid or derivatives
  • Cyclopropanecarboxylic acid
  • Cyclopropanecarboxylic acid or derivatives
  • Amino acid
  • Carboxylic acid
  • Monocarboxylic acid or derivatives
  • Organic nitrogen compound
  • Organooxygen compound
  • Organonitrogen compound
  • Primary amine
  • Primary aliphatic amine
  • Hydrocarbon derivative
  • Organic oxide
  • Organopnictogen compound
  • Carbonyl group
  • Amine
  • Organic oxygen compound
  • Aliphatic homomonocyclic compound
Molecular FrameworkAliphatic homomonocyclic compounds
External Descriptors
Physico-Chemical Properties - Experimental
PropertyValueReference
Experimental logP-2.78TSAI,RS ET AL. (1991)
Experimental Water SolubilityNot Available
Melting PointMp 229-231°DFC
Foods of Origin
FoodContent Range AverageReference
FoodReference
Production Data
Production Methodcommercial
Production Method ReferenceNot Available
Production Method Reference FileNot Available
Quantity AvailableProduction upon request, up to 100 mg
Delivery TimeNot Available
Storage FormNot Available
Storage Conditions-80°C
StabilityNot Available
PurityNot Available
Spectra
Spectral Data Upon RequestNot Available
Provider Information
Contact NameContact InstitutionContact Email
Rosa Vazquez Fresnovazquezf@ualberta.ca
Commercial Vendors
AKSci J90725
AKSci K924
AKSci HMDB0036458
Cayman Chemical 16132
Glentham GM9665
MetaSci HMDB0036458
Toronto Research Chemicals A603550