Amino-PEG13-amine

CAT: 0127-BUP16449Size: 10 mgDry Ice: NoHazardous: No

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CAT#:0127-BUP16449Size:10 mg

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CAS Number

1228119-65-0

Synonyms

H2N-PEG13-CH2CH2NH2

Purity

=98%

Smiles

NCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCN

Chemical Information

H2N-Peg13-CH2CH2NH2

CAS Number	1228119-65-0
PubChem CID	85786999
IUPAC Name	2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-aminoethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanamine
Molecular Formula	C28H60N2O13
Molecular Weight	632.8
XLogP	-3.6
Topological Polar Surface Area	172
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	15
Rotatable Bond Count	40
Heavy Atom Count	43
Formal Charge	0
Complexity	448

SMILES

C(COCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCN)N

InChI

InChI=1S/C28H60N2O13/c29-1-3-31-5-7-33-9-11-35-13-15-37-17-19-39-21-23-41-25-27-43-28-26-42-24-22-40-20-18-38-16-14-36-12-10-34-8-6-32-4-2-30/h1-30H2

InChIKey

SUSUFCWBLAIXDN-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 1228119-65-0

CID: 85786999

Formula: C28H60N2O13

MW: 632.8

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	632.8
XLogP3	-3.6
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	15
Rotatable Bond Count	40
Exact Mass	632.40953997
Monoisotopic Mass	632.40953997
Topological Polar Surface Area	172 Å²
Heavy Atom Count	43
Formal Charge	0
Complexity	448
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