N-Boc-3-pyrrolidinone Oxime - CAS 150008-25-6

Catalog:	BB010472
Product Name:	N-Boc-3-pyrrolidinone Oxime
CAS:	150008-25-6
Synonyms:	3-hydroxyimino-1-pyrrolidinecarboxylic acid tert-butyl ester; tert-butyl 3-hydroxyiminopyrrolidine-1-carboxylate

Technical Data

Patents

Computed Properties

IUPAC Name:	tert-butyl (3E)-3-hydroxyiminopyrrolidine-1-carboxylate
Description:	N-Boc-3-pyrrolidinone Oxime (CAS# 150008-25-6) is a useful research chemical.
Molecular Weight:	200.23
Molecular Formula:	C9H16N2O3
Canonical SMILES:	CC(C)(C)OC(=O)N1CCC(=NO)C1
InChI:	InChI=1S/C9H16N2O3/c1-9(2,3)14-8(12)11-5-4-7(6-11)10-13/h13H,4-6H2,1-3H3
InChI Key:	VGGFRVVFQKZXFV-UHFFFAOYSA-N
Boiling Point:	316.3 °C at 760 mmHg
Density:	1.18 g/cm³
LogP:	1.39530

Publication Number	Title	Priority Date
KR-100559494-B1	Novel 1-betamethylcarbapenem derivatives, preparation method thereof and pharmaceutical composition for antibiotics containing the same as an active ingredient	20031209
KR-20050055983-A	Novel 1Î²-methylcarbapenem derivatives, process of preparation thereof and pharmaceutical composition comprising the same for antibiotics	20031209
CA-2082334-A1	Oxime derivatives	19911108
EP-0541086-A1	Antibacterial 6-fluoro-quinolones having an oxime group on the substituent in position 7	19911108
JP-H05194487-A	Oxime derivative	19911108

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Complexity:	255
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	1
Exact Mass:	200.11609238
Formal Charge:	0
Heavy Atom Count:	14
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	200.11609238
Rotatable Bond Count:	2
Topological Polar Surface Area:	62.1
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	0.9