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2-[3-(tert-butoxycarbonylamino)cyclobutyl]acetic acid - 97%, high purity , CAS No.1638772-19-6
Basic Description
Synonyms | 2-(3-{[(tert-butoxy)carbonyl]amino}cyclobutyl)acetic acid | 2-(trans-3-((tert-Butoxycarbonyl)amino)cyclobutyl)acetic acid | MFCD28501915 | TRANS-2-(3-((TERT-BUTOXYCARBONYL)AMINO)CYCLOBUTYL)ACETIC ACID | 1434142-05-8 | 2-[trans-3-(Boc-amino)cyclobutyl]acet |
Specifications & Purity | ≥97% |
Shipped In | Normal |
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Names and Identifiers
IUPAC Name | 2-[3-[(2-methylpropan-2-yl)oxycarbonylamino]cyclobutyl]acetic acid |
INCHI | InChI=1S/C11H19NO4/c1-11(2,3)16-10(15)12-8-4-7(5-8)6-9(13)14/h7-8H,4-6H2,1-3H3,(H,12,15)(H,13,14) |
InChi Key | FITPVQKCXOGZGO-UHFFFAOYSA-N |
Canonical SMILES | CC(C)(C)OC(=O)NC1CC(C1)CC(=O)O |
Isomeric SMILES | CC(C)(C)OC(=O)NC1CC(C1)CC(=O)O |
Alternate CAS | 1434141-68-0,1434142-05-8,1638772-19-6 |
PubChem CID | 84692677 |
Molecular Weight | 229.27 |
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Certificates(CoA,COO,BSE/TSE and Analysis Chart)
Chemical and Physical Properties
Molecular Weight | 229.270 g/mol |
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XLogP3 | 1.200 |
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Hydrogen Bond Donor Count | 2 |
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Hydrogen Bond Acceptor Count | 4 |
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Rotatable Bond Count | 5 |
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Exact Mass | 229.131 Da |
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Monoisotopic Mass | 229.131 Da |
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Topological Polar Surface Area | 75.600 Ų |
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Heavy Atom Count | 16 |
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Formal Charge | 0 |
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Complexity | 276.000 |
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Isotope Atom Count | 0 |
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Defined Atom Stereocenter Count | 0 |
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Undefined Atom Stereocenter Count | 0 |
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Defined Bond Stereocenter Count | 0 |
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Undefined Bond Stereocenter Count | 0 |
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The total count of all stereochemical bonds | 0 |
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Covalently-Bonded Unit Count | 1 |
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Safety and Hazards(GHS)
Pictogram(s) | GHS07 |
Signal | Warning |
Hazard Statements | H315:Causes skin irritation H319:Causes serious eye irritation H302:Harmful if swallowed |
Precautionary Statements | P305+P351+P338:IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses if present and easy to do - continue rinsing. P280:Wear protective gloves/protective clothing/eye protection/face protection. P302+P352:IF ON SKIN: wash with plenty of water. P321:Specific treatment (see ... on this label). P501:Dispose of contents/container to ... P264:Wash hands [and …] thoroughly after handling. P362:Take off contaminated clothing. P270:Do not eat, drink or smoke when using this product. P337+P313:IF eye irritation persists: Get medical advice/attention. P332+P313:IF SKIN irritation occurs: Get medical advice/attention. P330:Rinse mouth. P301+P312:IF SWALLOWED: call a POISON CENTER/doctor/... IF you feel unwell. |
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