(S)-N-Boc-L-homoserine Ethyl Ester Tosylate - CAS 1331892-89-7

Catalog:	BB072438
Product Name:	(S)-N-Boc-L-homoserine Ethyl Ester Tosylate
CAS:	1331892-89-7
Synonyms:	N-[(1,1-Dimethylethoxy)carbonyl]-L-homoserine Ethyl Ester 4-Methylbenzenesulfonate

Technical Data

Computed Properties

IUPAC Name:	ethyl (2S)-4-(4-methylphenyl)sulfonyloxy-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoate
Description:	(S)-N-Boc-L-homoserine Ethyl Ester Tosylate (cas# 1331892-89-7) is a compound useful in organic synthesis.
Molecular Weight:	401.47
Molecular Formula:	C18H27NO7S
Canonical SMILES:	CCOC(=O)C(CCOS(=O)(=O)C1=CC=C(C=C1)C)NC(=O)OC(C)(C)C
InChI:	InChI=1S/C18H27NO7S/c1-6-24-16(20)15(19-17(21)26-18(3,4)5)11-12-25-27(22,23)14-9-7-13(2)8-10-14/h7-10,15H,6,11-12H2,1-5H3,(H,19,21)/t15-/m0/s1
InChI Key:	JIEKUIWRCLMXBI-HNNXBMFYSA-N

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Complexity:	584
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	1
Defined Bond Stereocenter Count:	0
Exact Mass:	401.15082337
Formal Charge:	0
Heavy Atom Count:	27
Hydrogen Bond Acceptor Count:	7
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	401.15082337
Rotatable Bond Count:	11
Topological Polar Surface Area:	116Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	3