Computed Properties
Complexity:
227
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
222.126g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
222.284g/mol
Monoisotopic Mass:
222.126g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
Synonyms
101267-73-6
2-[4-(TERT-PENTYL)PHENOXY]ACETIC ACID
BBB/389
DTXSID00586379
(4-tert-pentylphenoxy)acetic acid
ZINC8905531
ZX-AS003624
2-(4-tert-Pentylphenoxy)acetic acid
7331AC
7332AC
SBB080006
STL066598
[4-(1,1-dimethylpropyl)phenoxy]acetic acid
AKOS000125163
MCULE-6364301686
RTR-048147
KS-000042U7
ST088231
4-(2-methylbutan-2-yl)phenoxyacetic acid
BB0288720
TR-048147
AN-329/43385955
4-butoxy-3-ethoxybenzoic acid
[4-(2-methylbutan-2-yl)phenoxy]acetic acid
C13H18O3
C13H18O4
101268-36-4
Acetic acid, [4-(1,1-dimethylpropyl)phenoxy]-
2-[4-(1,1-dimethylpropyl)phenoxy]acetic acid
ACMC-20dxns
ARONIS011778
SCHEMBL5280680
CTK0D9685
