NH-bis (C2-PEG1-azide)

CAT: 0127-OR1005763-01Size: 50 mgDry Ice: NoHazardous: No

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CAT#:0127-OR1005763-01Size:50 mg

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CAS Number

2100306-81-6

Purity

98%

Smiles

[N-]=[N+]=NCCOCCNCCOCCN=[N+]=[N-]

Chemical Information

NH-bis(PEG1-azide)

CAS Number	2100306-81-6
PubChem CID	126961975
IUPAC Name	2-(2-azidoethoxy)-N-[2-(2-azidoethoxy)ethyl]ethanamine
Molecular Formula	C8H17N7O2
Molecular Weight	243.27
XLogP	1.3
Topological Polar Surface Area	59.2
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	7
Rotatable Bond Count	12
Heavy Atom Count	17
Formal Charge	0
Complexity	235

SMILES

C(COCCN=[N+]=[N-])NCCOCCN=[N+]=[N-]

InChI

InChI=1S/C8H17N7O2/c9-14-12-3-7-16-5-1-11-2-6-17-8-4-13-15-10/h11H,1-8H2

InChIKey

FXMWPZQWEUFICE-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 2100306-81-6

CID: 126961975

Formula: C8H17N7O2

MW: 243.27

Interactive 3D Structure

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Computed Properties

Property	Value
Molecular Weight	243.27
XLogP3	1.3
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	7
Rotatable Bond Count	12
Exact Mass	243.14437281
Monoisotopic Mass	243.14437281
Topological Polar Surface Area	59.2 Å²
Heavy Atom Count	17
Formal Charge	0
Complexity	235
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