Structure

Bis-PEG14-acid

CAS
1053656-79-3
Catalog Number
ACM1053656793
Category
Acid PEG Linkers
Molecular Weight
690.8g/mol
Molecular Formula
C30H58O17

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Specification

IUPAC Name
3-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-carboxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]propanoic acid
Canonical SMILES
C(COCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCC(=O)O)C(=O)O
InChI
InChI=1S/C30H58O17/c31-29(32)1-3-35-5-7-37-9-11-39-13-15-41-17-19-43-21-23-45-25-27-47-28-26-46-24-22-44-20-18-42-16-14-40-12-10-38-8-6-36-4-2-30(33)34/h1-28H2,(H,31,32)(H,33,34)
InChI Key
KOVYBDAGTRVAAO-UHFFFAOYSA-N
Complexity
592
Covalently-Bonded Unit Count
1
Exact Mass
690.3674g/mol
Formal Charge
0
H-Bond Acceptor
17
H-Bond Donor
2
Heavy Atom Count
47
Monoisotopic Mass
690.3674g/mol
Rotatable Bond Count
42
XLogP3
-2.7
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