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20605-01-0 | Propanedioic acid, 2,2-bis(hydroxymethyl)-, 1,3-diethyl ester
CAS No: 20605-01-0 Catalog No: AG002AII MDL No:MFCD00009130
Product Description
Catalog Number:
AG002AII
Chemical Name:
Propanedioic acid, 2,2-bis(hydroxymethyl)-, 1,3-diethyl ester
CAS Number:
20605-01-0
Molecular Formula:
C9H16O6
Molecular Weight:
220.2197
MDL Number:
MFCD00009130
IUPAC Name:
diethyl 2,2-bis(hydroxymethyl)propanedioate
InChI:
InChI=1S/C9H16O6/c1-3-14-7(12)9(5-10,6-11)8(13)15-4-2/h10-11H,3-6H2,1-2H3
InChI Key:
WIOHBOKEUIHYIC-UHFFFAOYSA-N
SMILES:
OCC(C(=O)OCC)(C(=O)OCC)CO
EC Number:
243-916-8
NSC Number:
218327
Properties
Complexity:
201
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
220.095g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
220.221g/mol
Monoisotopic Mass:
220.095g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
93.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.6
Literature
| Title | Journal |
|---|---|
| Reversible biotinylation phosphoramidite for 5'-end-labeling, phosphorylation, and affinity purification of synthetic oligonucleotides. | Bioconjugate chemistry 20030101 |
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