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Amyl 4-Carboxyphenyl Carbonate

Catalog Number
ACMA00014420
Product Name
Amyl 4-Carboxyphenyl Carbonate
Category
Liquid Crystal (LC) Building Blocks
IUPAC Name
4-pentoxycarbonyloxybenzoic acid
Molecular Weight
252.26g/mol
Molecular Formula
C13H16O5
Canonical SMILES
CCCCCOC(=O)OC1=CC=C(C=C1)C(=O)O
InChI
InChI=1S/C13H16O5/c1-2-3-4-9-17-13(16)18-11-7-5-10(6-8-11)12(14)15/h5-8H,2-4,9H2,1H3,(H,14,15)
InChI Key
RMIZZENBDILCRU-UHFFFAOYSA-N
Complexity
269
Covalently-Bonded Unit Count
1
Exact Mass
252.099774g/mol
Formal Charge
0
Heavy Atom Count
18
Monoisotopic Mass
252.099774g/mol
Rotatable Bond Count
8
XLogP3
3.4
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