3-(((Tert-butoxy)carbonyl)(methyl)amino)-2-methylpropanoic acid
Basic information
- CAS
1250447-76-7- Standard SMILES
CC(CN(C)C(=O)OC(C)(C)C)C(=O)O- InChIKey
CRADIPLTWJTMTH-UHFFFAOYSA-N- Molecular formula
- C10H19NO4
- Average molar mass
- 217.26 g/mol
- Monoisotopic mass
- 217.13140809
Names & identifiers
- Preferred name
- 3-(((Tert-butoxy)carbonyl)(methyl)amino)-2-methylpropanoic acid
- IUPAC
- 2-methyl-3-[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]propanoic acid
Names & synonyms
1250447-76-73-{[(tert-butoxy)carbonyl](methyl)amino}-2-methylpropanoic acid3-(((Tert-butoxy)carbonyl)(methyl)amino)-2-methylpropanoic acidRefChem:487991843-583-43-[Boc(methyl)amino]-2-methylpropanoic AcidMFCD160570722-methyl-3-[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]propanoic acidSCHEMBL10473405AAC44776AC8820AKOS010863685
Show more names
SY193633EN300-975363-(N-Boc-N-methylamino)-2-methylpropanoic acidZ8367159543-[tert-butoxycarbonyl(methyl)amino]-2-methyl-propanoic acid3-{[(tert-butoxy)carbonyl](methyl)amino}-2-methylpropanoicacid
Database identifiers
- CAS
1250447-76-7- PubChem CID
- 19854541
- EC Number
- 843-583-4
Properties
Computed structural properties
- XLogP
- 1.2
- Topological polar surface area
- 66.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 244
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%)
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Related reactions
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Compound notes
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