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115414-81-8 | 1,4-Benzenediacetic acid, 1,4-bis(1-methylethyl) ester
CAS No: 115414-81-8 Catalog No: AG000FZB MDL No:
Product Description
Catalog Number:
AG000FZB
Chemical Name:
1,4-Benzenediacetic acid, 1,4-bis(1-methylethyl) ester
CAS Number:
115414-81-8
IUPAC Name:
propan-2-yl 2-[4-(2-oxo-2-propan-2-yloxyethyl)phenyl]acetate
InChI:
InChI=1S/C16H22O4/c1-11(2)19-15(17)9-13-5-7-14(8-6-13)10-16(18)20-12(3)4/h5-8,11-12H,9-10H2,1-4H3
InChI Key:
HCZCXDDNYIPJLV-UHFFFAOYSA-N
Properties
Complexity:
282
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
278.152g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
278.348g/mol
Monoisotopic Mass:
278.152g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
52.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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