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SPDP-dPEG®8-Acid

CAT: 0926-DPG-6297-01Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0926-DPG-6297-01Size:100 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
1334177-99-9
Smiles
COC1=CC=C (C=C1) C (C2=CC=CC=C2) (C3=CC=CC=C3) NCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCC (=O) O
Molecular Formula
C47H71NO15
Molecular Weight
890.06 g/mol
Controlled
No

Chemical Information

Methoxytrityl-N-PEG24-acid
CAS Number1334177-99-9
PubChem CID51341032
IUPAC Name3-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[[(4-methoxyphenyl)-diphenylmethyl]amino]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]propanoic acid
Molecular FormulaC71H119NO27
Molecular Weight1418.7
XLogP-1.9
Topological Polar Surface Area280
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count28
Rotatable Bond Count80
Heavy Atom Count99
Formal Charge0
Complexity1600
SMILES
COC1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)NCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCC(=O)O
InChI
InChI=1S/C71H119NO27/c1-75-69-14-12-68(13-15-69)71(66-8-4-2-5-9-66,67-10-6-3-7-11-67)72-17-19-77-21-23-79-25-27-81-29-31-83-33-35-85-37-39-87-41-43-89-45-47-91-49-51-93-53-55-95-57-59-97-61-63-99-65-64-98-62-60-96-58-56-94-54-52-92-50-48-90-46-44-88-42-40-86-38-36-84-34-32-82-30-28-80-26-24-78-22-20-76-18-16-70(73)74/h2-15,72H,16-65H2,1H3,(H,73,74)
InChIKey
IKBZDOBLUDXNKC-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Methoxytrityl-N-PEG24-acid
CAS: 1334177-99-9
CID: 51341032
Formula: C71H119NO27
MW: 1418.7
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight1418.7
XLogP3-1.9
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count28
Rotatable Bond Count80
Exact Mass1417.79694752
Monoisotopic Mass1417.79694752
Topological Polar Surface Area280 Ų
Heavy Atom Count99
Formal Charge0
Complexity1600
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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