(2R)-6-{[(benzyloxy)carbonyl]amino}-2-{[(tert-butoxy)carbonyl]amino}hexanoic acid
Completing data — refresh the page later to see the latest
Basic information
- CAS
55878-47-2- Standard SMILES
CC(C)(C)OC(=O)N[C@H](CCCCNC(=O)OCc1ccccc1)C(=O)O- InChIKey
BDHUTRNYBGWPBL-OAHLLOKOSA-N- Molecular formula
- C19H28N2O6
- Average molar mass
- 380.4 g/mol
- Monoisotopic mass
- 380.19473662
Names & identifiers
- Preferred name
- (2R)-6-{[(benzyloxy)carbonyl]amino}-2-{[(tert-butoxy)carbonyl]amino}hexanoic acid
- IUPAC
- (2R)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-6-(phenylmethoxycarbonylamino)hexanoic acid
- English name
- Boc-D-Lys(Z)-OH
- Molecular formula
- C19H28N2O6
- Molecular weight
- 380.44
Names & synonyms
N2-[(1,1-Dimethylethoxy)carbonyl]-N6-[(phenylmethoxy)carbonyl]-D-lysine(2R)-6-{[(benzyloxy)carbonyl]amino}-2-{[(tert-butoxy)carbonyl]amino}hexanoic acidN2-((1,1-Dimethylethoxy)carbonyl)-N6-((phenylmethoxy)carbonyl)-D-lysine(2R)-6-(((benzyloxy)carbonyl)amino)-2-(((tert-butoxy)carbonyl)amino)hexanoic acidRefChem:397400965-875-1Boc-D-Lys(Z)-OH55878-47-2MFCD00038262N6-((Benzyloxy)carbonyl)-N2-(tert-butoxycarbonyl)-D-lysine(2R)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-6-(phenylmethoxycarbonylamino)hexanoic acidN-alpha-Boc-Nepsilon-Z-D-lysine
Show more names
NSC 334941Nα-Boc-Nε-Z-D-lysineN2-Boc-N6-Cbz-D-lysineNα-Boc-Nε-Z-D-lysine≥ 98% (HPLC)(Tert-Butoxy)Carbonyl D-Lys(Z)-OH
Nalpha-Boc-Nepsilon-Z-D-lysineBOC-N-EPSILON-Z-D-LYSINEBoc-D-Lys(Cbz)-OHBOC-D-Lys(Z)BOC-D-LYSINE(CBZ)BOC-D-LYSINE(Z)-OHSCHEMBL3210903BDHUTRNYBGWPBL-OAHLLOKOSA-N
Properties
Computed structural propertiesFilling in
- XLogP
- 2.8
- Topological polar surface area
- 114 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 12
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 483
Physicochemical properties
- Boiling point
- 587 · 587.0±50.0 °C(Predicted)
- Density
- 1.176 · 1.176±0.06 g/cm3(Predicted)
- storage temp.
- 2 · Sealed in dry,2-8°C
- solubility
- Soluble in Chloroform,Dichloromethane,Ethyl Acetate,DMSO,Acetone,etc.
- form
- Powder
- pka
- 3.99 · 3.99±0.21(Predicted)
- Appearance
- White to off-white Solid
- optical activity
- Consistent with structure
- 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.
GHS classification
GHS Classification
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P305+P351+P338
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Related reactions
2 records
Compound notes
Loading…