BOC-L-Threonine extrapure, 99%

CAT: 0565-77340-01Size: 10 gDry Ice: NoHazardous: No

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CAT#:0565-77340-01Size:10 g

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Description

Part B

CAS Number

2592-18-9

Storage Temperature

0 - 4°C

Chemical Information

N-(tert-butyloxycarbonyl)-L-threonine

CAS Number	2592-18-9
PubChem CID	100116
IUPAC Name	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

CC(C(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)

InChIKey

LLHOYOCAAURYRL-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 2592-18-9

CID: 100116

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	0
Undefined Atom Stereocenter Count	2
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

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