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N-Boc-4-pentyne-1-amine
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N-Boc-4-pentyne-1-amine

Catalog NumberCCR151978506
CAS151978-50-6
Structure
Synonyms4-Pentynylcarbamic acid tert-butyl ester
IUPAC Nametert-Butyl N-pent-4-ynylcarbamate
Molecular Weight183.25
Molecular FormulaC10H17NO2
Canonical SMILESCC(C)(C)OC(=O)NCCCC#C
InChIInChI=1S/C10H17NO2/c1-5-6-7-8-11-9(12)13-10(2,3)4/h1H,6-8H2,2-4H3,(H,11,12)
InChI KeyJTPJJKZSKWNWKK-UHFFFAOYSA-N
Boiling Point267.2±23.0 °C(Predicted)
Purity98%+
Density0.965±0.06 g/cm3(Predicted)
ApplicationCuAAC & Thiol-Yne & Spontaneous Amino-Yne Click Reaction
Complexity207
Exact Mass183.125928785
Monoisotopic Mass183.125928785
pKa12.61±0.46(Predicted)
Topological Polar Surface Area38.3 Ų

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