(R)-4-Amino-2-(((benzyloxy)carbonyl)amino)butanoic acid
Basic information
- CAS
70882-66-5- Standard SMILES
NCC[C@@H](NC(=O)OCc1ccccc1)C(=O)O- InChIKey
KXMSCBRTBLPGIN-SNVBAGLBSA-N- Molecular formula
- C12H16N2O4
- Average molar mass
- 252.27 g/mol
- Monoisotopic mass
- 252.111007
Names & identifiers
- Preferred name
- (R)-4-Amino-2-(((benzyloxy)carbonyl)amino)butanoic acid
- IUPAC
- (2R)-4-amino-2-(phenylmethoxycarbonylamino)butanoic acid
- English name
- N-alpha-Cbz-D-2-4-diaminobutanoic acid
- Molecular formula
- C12H16N2O4
- Molecular weight
- 252.27
Names & synonyms
70882-66-5Z-D-DAB-OHCbz-D-2,4-Diaminobutyric acid(R)-4-Amino-2-(((benzyloxy)carbonyl)amino)butanoic acidN-alpha-Cbz-D-2-4-diaminobutanoic acidMFCD00237344N-ALPHA-BENZYLOXYCARBONYL-D-2,4-DIAMINOBUTYRIC ACID(2R)-4-amino-2-(phenylmethoxycarbonylamino)butanoic acid(2R)-4-azaniumyl-2-(phenylmethoxycarbonylamino)butanoate(R)-4-Amino-2-(Cbz-amino)butanoic AcidCID 7019791Cbz-D-|A-Dab-OH
Show more names
CBZ-D-Dab-OHCbz-D-Daba-OHZ-D-2,4-DIAMINOBUTYRIC ACIDNα-Z-D-2,4-diaminobutyric acidN-α-Cbz-D-2-4-diaMinobutanoic acidZ-D-ALPHA,GAMMA-DIAMINOBUTYRIC ACID
BUTANOIC ACID, 4-AMINO-2-[[(PHENYLMETHOXY)CARBONYL]AMINO]-, (2R)-SCHEMBL14561115DTXSID80427170(2R)-4-AMINO-2-{[(BENZYLOXY)CARBONYL]AMINO}BUTANOIC ACIDFD1085AKOS016842448CS-W006992AC-23760
Database identifiers
- CAS
70882-66-5- PubChem CID
- 7019792
- DTXSID
DTXSID80427170
Properties
Computed structural properties
- XLogP
- -1.8
- Topological polar surface area
- 102 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 7
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 277
Physicochemical properties
- Boiling point
- 480.3 · 480.3±45.0 °C(Predicted)
- Density
- 1.266 · 1.266±0.06 g/cm3(Predicted)
- storage temp.
- 2 · Keep in dark place,Inert atmosphere,2-8°C
- pka
- 3.62 · 3.62±0.10(Predicted)
- Appearance
- White to off-white Solid
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P305+P351+P338
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P305+P351+P338
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Compound notes
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