Carbobenzyloxy-L-valyl-L-isoleucine
Basic information
- CAS
41486-97-9- Standard SMILES
CCC(C)C(NC(=O)C(NC(=O)OCc1ccccc1)C(C)C)C(=O)O- InChIKey
WRWKLZMOFAMVPZ-BPUTZDHNSA-N- Molecular formula
- C19H28N2O5
- Average molar mass
- 364.4 g/mol
- Monoisotopic mass
- 364.199822
Names & identifiers
- Preferred name
- Carbobenzyloxy-L-valyl-L-isoleucine
- IUPAC
- 3-methyl-2-[[3-methyl-2-(phenylmethoxycarbonylamino)butanoyl]amino]pentanoic acid
- English name
- Z-Val-Ile-OH
- Molecular formula
- C19H28N2O5
- Molecular weight
- 364.44
Names & synonyms
41486-97-9CARBOBENZYLOXY-L-VALYL-L-ISOLEUCINERefChem:574225664-992-2Cbz-Val-Ile-OHMFCD00027065N-Cbz-L-valyl-L-isoleucineCCG-50223Z-Val-Ile-OH (C-2865.0005)((Benzyloxy)carbonyl)-l-valyl-l-isoleucineDB-049768G84387
Show more names
Z-Val-Ile-OHZ-Val-Ile-OH99%Z-L-VALYL ISOLEUCINEL-Isoleucine, N-[(phenylmethoxy)carbonyl]-L-valyl-
SR-01000639618-12-[[2-(benzyloxycarbonylamino)-3-methyl-butanoyl]amino]-3-methyl-pentanoic acid
Database identifiers
- CAS
41486-97-9- PubChem CID
- 2802887
- EC Number
- 664-992-2
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 105 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 10
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 475
Physicochemical properties
- Boiling point
- 590.1 · 590.1±45.0 °C(Predicted)
- Density
- 1.145 · 1.145±0.06 g/cm3(Predicted)
- storage temp.
- -15 °C · -15°C
- pka
- 3.47 · 3.47±0.10(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H335-H319
- Precautionary statements
- 264 · P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
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)
Aggregated GHS information provided per 39 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H315-H335-H319
- Precautionary statements
- P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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