Azido-PEG6-NHS ester

CAT: 0127-BIPG1158-01Size: 100 mgDry Ice: NoHazardous: No

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CAT#:0127-BIPG1158-01Size:100 mg

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CAS Number

2055014-64-5

MDL Number

MFCD22683276

Smiles

[N-]=[N+]=NCCOCCOCCOCCOCCOCCOCCC(=O)ON1C(=O)CCC1=O

Chemical Information

Azido-PEG6-NHS ester

CAS Number	2055014-64-5
PubChem CID	77078479
IUPAC Name	(2,5-dioxopyrrolidin-1-yl) 3-[2-[2-[2-[2-[2-(2-azidoethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]propanoate
Molecular Formula	C19H32N4O10
Molecular Weight	476.5
XLogP	-0.8
Topological Polar Surface Area	133
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	12
Rotatable Bond Count	23
Heavy Atom Count	33
Formal Charge	0
Complexity	599

SMILES

C1CC(=O)N(C1=O)OC(=O)CCOCCOCCOCCOCCOCCOCCN=[N+]=[N-]

InChI

InChI=1S/C19H32N4O10/c20-22-21-4-6-28-8-10-30-12-14-32-16-15-31-13-11-29-9-7-27-5-3-19(26)33-23-17(24)1-2-18(23)25/h1-16H2

InChIKey

WXKOAPGNZNSYPW-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 2055014-64-5

CID: 77078479

Formula: C19H32N4O10

MW: 476.5

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	476.5
XLogP3	-0.8
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	12
Rotatable Bond Count	23
Exact Mass	476.21184323
Monoisotopic Mass	476.21184323
Topological Polar Surface Area	133 Å²
Heavy Atom Count	33
Formal Charge	0
Complexity	599
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