Computed Properties
Complexity:
226
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
209.069g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
209.201g/mol
Monoisotopic Mass:
209.069g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
57.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
Synonyms
3,4,5-Trimethoxyphenyl isocyanate
1016-19-9
SCHEMBL374491
CTK3J6021
3,4,5-trimethoxyphenylisocyanate
DTXSID50333714
3,4,5-Trimetoxyphenyl ispcyanate
ALBB-007527
ZINC2560438
ZX-AN007049
3, 4, 5-trimethoxyphenylisocyanate
3,4,5-trimethoxy-isocyanato benzene
5-Isocyanato-1,2,3-trimethoxybenzene
7400AC
MFCD00013861
SBB048858
STK501316
AKOS000167586
CHM0022618
MCULE-9024017711
RTR-000406
5-isocyanato-1,2,3-trimethoxy-benzene
3,4,5-Trimethoxyphenyl isocyanate, 97%
3,4,5-Trimethoxyphenyl cyanate
5-Isocyanato-1,2,3-trimethoxybenzene #
BP-12566
OR322068
3,4,5-TRIMETHOXY PHENYL ISOCYANATE
AB1002623
TR-000406
BB 0254498
FT-0614172
R1262
ST50825578
MJJXWPHZDBIHIM-UHFFFAOYSA-N
C-51591
J-000451
I01-15543
F2160-0005
InChI=1/C10H11NO4/c1-13-8-4-7(11-6-12)5-9(14-2)10(8)15-3/h4-5H,1-3H
null
C10H11NO4
CID517766
ZINC02560438
3,4,5-trimethoxybenzenisocyanate
AC1LAPBT
ACMC-20ang3
Benzene, 5-isocyanato-1,2,3-trimethoxy-
AC1Q47QD
