Basic information
- CAS
73537-09-4- Standard SMILES
C#C[C@H](N)C(=O)O- InChIKey
DSUAJFIEKRKPEE-VKHMYHEASA-N- Molecular formula
- C4H5NO2
- Average molar mass
- 99.09 g/mol
- Monoisotopic mass
- 99.0320284
Overview
produced by Streptomyces catenulae; unstable in aqueous solution; previously reported as corrosion inhibitor; structure in first source
Names & identifiers
- Preferred name
- L-2-amino-3-butynoic acid
- IUPAC
- (2S)-2-aminobut-3-ynoic acid
- English name
- L-2-amino-3-butynoic acid
- Molecular formula
- C4H5NO2
- Molecular weight
- 99.09
Names & synonyms
L-2-amino-3-butynoic acid(2S)-2-aminobut-3-ynoic acid73537-09-43-Butynoic acid, 2-amino-, (S)-DTXSID60223738RefChem:151742DTXCID90146229(S)-2-Aminobut-3-ynoic acidAntibiotic FR 900130(S)-2-Amino-3-butynoic acid(2S)-2-Amino-3-butynoic acidSCHEMBL383651
Show more names
FR-900130Antibiotic FR-900130(S)-2-aminobut-3-ynoic?acid
DB04217NS00069942Q270950432-AMINO-BUT-3-YNOIC ACID; 2-amino-3-butynoic acid
Database identifiers
- CAS
73537-09-4- PubChem CID
- 175496
- DTXSID
DTXSID60223738- Nikkaji
- J93.429A
Properties
Computed structural properties
- XLogP
- -3.1
- Topological polar surface area
- 63.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 7
- Formal charge
- 0
- Complexity
- 121
Experimental & physicochemical properties
DrugsPharmaceuticals -> Listed in ZINC15
Physicochemical properties
- Boiling point
- 275.014 · 275.014±30.00 °C(Press: 760.00 Torr)(predicted)
- Density
- 1.287 · 1.287±0.06 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
- pka
- 1.259 · 1.259±0.10(predicted)
Chemistry & industry
Suppliers1 total
北京珐默兹医药科技有限公司15811073878 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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