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1443303-38-5 | Ethyl 2-iso-butoxy-5-chlorobenzoylformate
CAS No: 1443303-38-5 Catalog No: AG01FBMO MDL No:
Product Description
Catalog Number:
AG01FBMO
Chemical Name:
Ethyl 2-iso-butoxy-5-chlorobenzoylformate
CAS Number:
1443303-38-5
Molecular Formula:
C14H17ClO4
Molecular Weight:
284.7354
IUPAC Name:
ethyl 2-[5-chloro-2-(2-methylpropoxy)phenyl]-2-oxoacetate
InChI:
InChI=1S/C14H17ClO4/c1-4-18-14(17)13(16)11-7-10(15)5-6-12(11)19-8-9(2)3/h5-7,9H,4,8H2,1-3H3
InChI Key:
HJPFUKOCRNETIO-UHFFFAOYSA-N
SMILES:
CCOC(=O)C(=O)c1cc(Cl)ccc1OCC(C)C
Properties
Complexity:
317
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
284.082g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
284.736g/mol
Monoisotopic Mass:
284.082g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
52.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4
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