BocNH-PEG5-acid

CAT: 0024-sc-506322ASize: 1 gDry Ice: NoHazardous: No

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CAT#:0024-sc-506322ASize:1 g

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CAS Number

890152-41-7

Chemical Information

t-Boc-N-amido-PEG5-acetic acid

CAS Number	890152-41-7
PubChem CID	138393105
IUPAC Name	2-[2-[2-[2-[2-[2-[(2-methylpropan-2-yl)oxycarbonylamino]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]acetic acid
Molecular Formula	C17H33NO9
Molecular Weight	395.4
XLogP	-0.2
Topological Polar Surface Area	122
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	9
Rotatable Bond Count	19
Heavy Atom Count	27
Formal Charge	0
Complexity	385

SMILES

CC(C)(C)OC(=O)NCCOCCOCCOCCOCCOCC(=O)O

InChI

InChI=1S/C17H33NO9/c1-17(2,3)27-16(21)18-4-5-22-6-7-23-8-9-24-10-11-25-12-13-26-14-15(19)20/h4-14H2,1-3H3,(H,18,21)(H,19,20)

InChIKey

OLLNIAGWMCSEJB-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 890152-41-7

CID: 138393105

Formula: C17H33NO9

MW: 395.4

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	395.4
XLogP3	-0.2
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	9
Rotatable Bond Count	19
Exact Mass	395.21553163
Monoisotopic Mass	395.21553163
Topological Polar Surface Area	122 Å²
Heavy Atom Count	27
Formal Charge	0
Complexity	385
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
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-498408	C18-PEG5-Acid
sc-498189	Mal-PEG5-acid
sc-497044	DBCO-NHCO-PEG5-acid
sc-496201	Bromo-PEG5-phosphonic acid
sc-496131	Acid-PEG5-NHS ester
sc-496205	Diethoxy-phosphorylethyl-PEG5-ethylphosphonic acid
sc-496224	Cbz-N-amido-PEG5-acid
sc-496947	THP-PEG5
sc-496393	Azido-PEG5-alcohol
sc-496692	Ald-PEG5-Azide