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Home > Fluorides > 137891-30-6
137891-30-6 | 2-Propenoic acid, 2-(heptafluorobutoxy)ethyl ester (9CI)
CAS No: 137891-30-6 Catalog No: AG00141W MDL No:
Product Description
Catalog Number:
AG00141W
Chemical Name:
2-Propenoic acid, 2-(heptafluorobutoxy)ethyl ester (9CI)
CAS Number:
137891-30-6
Molecular Formula:
C9H9F7O3
Molecular Weight:
298.1548
IUPAC Name:
2-(1,1,2,2,4,4,4-heptafluorobutoxy)ethyl prop-2-enoate
InChI:
InChI=1S/C9H9F7O3/c1-2-6(17)18-3-4-19-9(15,16)7(10,11)5-8(12,13)14/h2H,1,3-5H2
InChI Key:
IBCACYBEWWASTF-UHFFFAOYSA-N
SMILES:
C=CC(=O)OCCOC(C(CC(F)(F)F)(F)F)(F)F
Properties
Complexity:
324
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
298.044g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
10
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
298.157g/mol
Monoisotopic Mass:
298.044g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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