Boc-D-threonine

CAT: 0024-sc-293762ASize: 5 gDry Ice: NoHazardous: No

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CAT#:0024-sc-293762ASize:5 g

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CAS Number

55674-67-4

Chemical Information

(2R,3S)-2-(((tert-butoxy)carbonyl)amino)-3-hydroxybutanoic acid

CAS Number	55674-67-4
PubChem CID	6992541
IUPAC Name	(2R,3S)-3-hydroxy-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoic acid
Molecular Formula	C9H17NO5
Molecular Weight	219.23
XLogP	0.3
Topological Polar Surface Area	95.9
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	5
Heavy Atom Count	15
Formal Charge	0
Complexity	245

SMILES

C[C@@H]([C@H](C(=O)O)NC(=O)OC(C)(C)C)O

InChI

InChI=1S/C9H17NO5/c1-5(11)6(7(12)13)10-8(14)15-9(2,3)4/h5-6,11H,1-4H3,(H,10,14)(H,12,13)/t5-,6+/m0/s1

InChIKey

LLHOYOCAAURYRL-NTSWFWBYSA-N

Chemical Structure

2D Structure

CAS: 55674-67-4

CID: 6992541

Formula: C9H17NO5

MW: 219.23

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	219.23
XLogP3	0.3
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	5
Exact Mass	219.11067264
Monoisotopic Mass	219.11067264
Topological Polar Surface Area	95.9 Å²
Heavy Atom Count	15
Formal Charge	0
Complexity	245
Isotope Atom Count	0
Defined Atom Stereocenter Count	2
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
sc-285227A	Boc-O-tert-butyl-D-threonine
sc-285227	Boc-O-tert-butyl-D-threonine
sc-479042	Boc-O-benzyl-D-threonine merrifield resin
sc-479042A	Boc-O-benzyl-D-threonine merrifield resin
sc-473582	Boc-L-threonine
sc-473504	Boc-O-benzyl-D-threonine 4-oxymethylphenylacetamidomethyl resin
sc-280660	D-Threonine
sc-293883	Boc-L-threonine hydrazide
sc-293883A	Boc-L-threonine hydrazide
sc-293724	Boc-D-cyclopropylglycine

Catalog	Name
264831-01	Boc-D-threonine
458348-01	N-Boc-D-threonine
236256-01	Boc-D-threonine 98+% (HPLC)
73138-01	BOC-D-Threonine extrapure, 98%
264742-01	Boc-O-benzyl-D-threonine
265056-01	Boc-O-tert-butyl-D-threonine
236599-01	Boc-O-benzyl-D-threonine Merrifield resin
236597-01	Boc-O-benzyl-D-threonine 99+% (HPLC)
BOC260-01	BOC-L-Threonine
236598-01	Boc-O-benzyl-D-threonine 4-oxymethylphenylacetamidomethyl resin