N-Cbz-O-tosylhydroxylamine - CAS 64420-86-6

Catalog:	BB032465
Product Name:	N-Cbz-O-tosylhydroxylamine
CAS:	64420-86-6
Synonyms:	4-methylbenzenesulfonic acid phenylmethoxycarbonylamino ester; phenylmethoxycarbonylamino 4-methylbenzenesulfonate

Technical Data

Patents

Computed Properties

IUPAC Name:	phenylmethoxycarbonylamino 4-methylbenzenesulfonate
Description:	N-Cbz-O-tosylhydroxylamine (CAS# 64420-86-6 ) is a useful research chemical.
Molecular Weight:	321.35
Molecular Formula:	C15H15NO5S
Canonical SMILES:	CC1=CC=C(C=C1)S(=O)(=O)ONC(=O)OCC2=CC=CC=C2
InChI:	InChI=1S/C15H15NO5S/c1-12-7-9-14(10-8-12)22(18,19)21-16-15(17)20-11-13-5-3-2-4-6-13/h2-10H,11H2,1H3,(H,16,17)
InChI Key:	FKRJSQPWBQOSSW-UHFFFAOYSA-N
LogP:	3.82690

Publication Number	Title	Priority Date
CN-104529830-A	Novel urea type compound preparation method	20150115
CA-1117948-A	Clavulanic acid derivatives	19770427
GB-1603208-A	Aminodeoxyclavulanic acid and acyl derivatives threreof	19770427
IE-46742-B1	9-aminodeoxyclavulanic acid and acyl derivatives thereof	19770427
IE-780837-L	Clavulanic acid derivatives, anti-bacterial agents	19770427

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Complexity:	445
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	321.06709375
Formal Charge:	0
Heavy Atom Count:	22
Hydrogen Bond Acceptor Count:	5
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	321.06709375
Rotatable Bond Count:	6
Topological Polar Surface Area:	90.1
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	3