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85888-76-2 | 2-Propenoic acid, 2-[3-[(2-chloroethyl)sulfonyl]-1-oxopropoxy]ethyl ester
CAS No: 85888-76-2 Catalog No: AG004QRJ MDL No:
Product Description
Catalog Number:
AG004QRJ
Chemical Name:
2-Propenoic acid, 2-[3-[(2-chloroethyl)sulfonyl]-1-oxopropoxy]ethyl ester
CAS Number:
85888-76-2
Molecular Formula:
C10H15ClO6S
Molecular Weight:
298.7405
IUPAC Name:
2-prop-2-enoyloxyethyl 3-(2-chloroethylsulfonyl)propanoate
InChI:
InChI=1S/C10H15ClO6S/c1-2-9(12)16-5-6-17-10(13)3-7-18(14,15)8-4-11/h2H,1,3-8H2
InChI Key:
KXSNTZCQKNKBOW-UHFFFAOYSA-N
SMILES:
ClCCS(=O)(=O)CCC(=O)OCCOC(=O)C=C
Properties
Complexity:
384
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
298.028g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
298.734g/mol
Monoisotopic Mass:
298.028g/mol
Rotatable Bond Count:
11
Topological Polar Surface Area:
95.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5
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