Boc-β-alanine Hydrazide - CAS 42116-56-3
Catalog: |
BB061618 |
Product Name: |
Boc-β-alanine Hydrazide |
CAS: |
42116-56-3 |
Synonyms: |
tert-Butyl (3-hydrazino-3-oxopropyl)carbamate; Boc-beta-Alanine hydrazide; tert-butyl (3-hydrazinyl-3-oxopropyl)carbamate; tert-butyl N-(3-hydrazinyl-3-oxopropyl)carbamate; (2-Hydrazinocarbonyl-ethyl)-carbamic acid tert-butyl ester; tert-butyl 3-hydrazinyl-3-oxopropylcarbamate; tert-butyl(3-hydrazinyl-3-oxopropyl)carbamate; TERT-BUTYL N-[2-(HYDRAZINECARBONYL)ETHYL]CARBAMATE |
IUPAC Name: | tert-butyl N-(3-hydrazinyl-3-oxopropyl)carbamate |
Molecular Weight: | 203.24 |
Molecular Formula: | C8H17N3O3 |
Canonical SMILES: | CC(C)(C)OC(=O)NCCC(=O)NN |
InChI: | InChI=1S/C8H17N3O3/c1-8(2,3)14-7(13)10-5-4-6(12)11-9/h4-5,9H2,1-3H3,(H,10,13)(H,11,12) |
InChI Key: | IEQUZNXTFVGDPD-UHFFFAOYSA-N |
Complexity: | 210 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 203.12699141 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 3 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 203.12699141 |
Rotatable Bond Count: | 5 |
Topological Polar Surface Area: | 93.4Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | -0.6 |
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