Basic information
- CAS
74644-88-5- Standard SMILES
O=C(O)[C@H]1NC[C@@H](O)[C@@H]1O- InChIKey
HWNGLKPRXKKTPK-UZBSEBFBSA-N- Molecular formula
- C5H9NO4
- Average molar mass
- 147.13 g/mol
- Monoisotopic mass
- 147.05315777
Names & identifiers
- Preferred name
- (2S,3R,4R)-3,4-dihydroxypyrrolidine-2-carboxylic acid
- IUPAC
- (2S,3R,4R)-3,4-dihydroxypyrrolidine-2-carboxylic acid
- English name
- L-Proline, 3,4-dihydroxy-, (3R,4R)- (9CI)
- Molecular formula
- C5H9NO4
- Molecular weight
- 147.13
Names & synonyms
74644-88-52S,3R,4R-3,4-Dihydroxyproline(2S,3R,4R)-3,4-dihydroxypyrrolidine-2-carboxylic acidL-Proline, 3,4-dihydroxy-, (3R,4R)-(3R,4R)-3,4-DIHYDROXY-L-PROLINED-Proline, 3,4-dihydroxy-, (3S,4S)-rel- (9CI)103366-25-2SCHEMBL8430165HWNGLKPRXKKTPK-UZBSEBFBSA-N(2s,3r,4r)-3,4-dihydroxyprolineAKOS006348930(2S, 3R, 4R)-3,4-dihydroxyproline
Show more names
L-Proline, 3,4-dihydroxy-, (3R,4R)- (9CI)
Database identifiers
- CAS
74644-88-5- PubChem CID
- 452017
- Nikkaji
- J424.545H
Properties
Computed structural properties
- XLogP
- -3.8
- Topological polar surface area
- 89.8 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 1
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 149
Physicochemical properties
- Melting point
- 220 · 220-245 °C (decomp)
- Boiling point
- 411.5 · 411.5±45.0 °C(Predicted)
- Density
- 1.617 · 1.617±0.06 g/cm3(Predicted)
- pka
- 1.82 · 1.82±0.60(Predicted)
Chemistry & industry
Suppliers1 total
北京科易通达科技发展有限公司17743531240 · [email protected]
Related reactions
1 records
Compound notes
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