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7507-48-4 | tert-Butylhydroquinone diacetate
CAS No: 7507-48-4 Catalog No: AG003ULU MDL No:MFCD00078251
Product Description
Catalog Number:
AG003ULU
Chemical Name:
tert-Butylhydroquinone diacetate
CAS Number:
7507-48-4
Molecular Formula:
C14H18O4
Molecular Weight:
250.2903
MDL Number:
MFCD00078251
IUPAC Name:
(4-acetyloxy-3-tert-butylphenyl) acetate
InChI:
InChI=1S/C14H18O4/c1-9(15)17-11-6-7-13(18-10(2)16)12(8-11)14(3,4)5/h6-8H,1-5H3
InChI Key:
SJRALGDWZXRRKL-UHFFFAOYSA-N
SMILES:
CC(=O)Oc1ccc(c(c1)C(C)(C)C)OC(=O)C
EC Number:
231-364-0
NSC Number:
407992
Properties
Complexity:
316
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
250.121g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
250.294g/mol
Monoisotopic Mass:
250.121g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
52.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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