Computed Properties
Complexity:
242
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
281.95g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
283.044g/mol
Monoisotopic Mass:
281.95g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
Synonyms
Methyl 2-bromo-5-(trifluoromethyl)benzoate
1026355-57-6
AKOS016003886
SC-42598
AJ-110608
TC-152662
FT-0723688
ST24047688
Y3541
Q-7964
Benzoic acid, 2-bromo-5-(trifluoromethyl)-, methyl ester
C9H6BrF3O2
2-Bromo-5-(trifluoromethyl)benzoic acid methyl ester
CID10869779
Methyl2-bromo-5-(trifluoromethyl)benzoate
SCHEMBL15561128
CTK8C0032
DTXSID10446571
ISBKZHUQXJKCKP-UHFFFAOYSA-N
ANW-63917
MFCD09999461
ZINC47202247
