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654673-74-2 | Propanedioic acid, (2,2-dimethoxyethyl)(iodomethyl)-, diethyl ester
CAS No: 654673-74-2 Catalog No: AG006Q5Q MDL No:
Product Description
Catalog Number:
AG006Q5Q
Chemical Name:
Propanedioic acid, (2,2-dimethoxyethyl)(iodomethyl)-, diethyl ester
CAS Number:
654673-74-2
Molecular Formula:
C12H21IO6
Molecular Weight:
388.1960
IUPAC Name:
diethyl 2-(2,2-dimethoxyethyl)-2-(iodomethyl)propanedioate
InChI:
InChI=1S/C12H21IO6/c1-5-18-10(14)12(8-13,11(15)19-6-2)7-9(16-3)17-4/h9H,5-8H2,1-4H3
InChI Key:
RSLHRLMQSNKMDU-UHFFFAOYSA-N
SMILES:
CCOC(=O)C(C(=O)OCC)(CC(OC)OC)CI
Properties
Complexity:
272
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
388.038g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
388.198g/mol
Monoisotopic Mass:
388.038g/mol
Rotatable Bond Count:
11
Topological Polar Surface Area:
71.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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