Computed Properties
Complexity:
225
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
177.043g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
177.159g/mol
Monoisotopic Mass:
177.043g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
47.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
Synonyms
100275-94-3
6-isocyanato-2,3-dihydro-1,4-benzodioxine
6-isocyanato-1,4-benzodioxan
3,4-ethylenedioxyphenylisocyanate
CTK3J8724
DTXSID20379866
OGVYMEFCSKVNQH-UHFFFAOYSA-N
ALBB-003046
ZINC4277235
BBL037664
MFCD02677705
STK502566
2,3-Dihydro-1,4-benzodioxin-6-yl isocyanate
AKOS000265756
6-Isocyanato-1,4-benzodioxane, 97%
MCULE-7504160930
RP03032
RTR-053075
VZ22258
TR-053075
2,3-Dihydro-6-isocyanato-1,4-benzodioxine
2,3-Dihydrobenzo[1,4]dioxin-6-ylisocyanate
FT-0609628
6-Isocyanato-1,4-benzodioxane
R6073
Y6766
1,4-Benzodioxin, 2,3-dihydro-6-isocyanato-
2,3-dihydrobenzo[1,4]dioxin-6-yl isocyanate
6-isocyanato-2,3-dihydro-benzo[1,4]dioxine
6-isocyanato-2,3-dihydrobenzo[b][1,4]dioxine
W-204357
I14-35303
C9H7NO3
ZINC04277235
1,4-Benzodioxin,2,3-dihydro-6-isocyanato-
CID2776172
1,4-Benzodioxin, 2,3-dihydro-6-isocyanato- (9CI)
2,3-Dihydro-1,4-benzodioxin-6-ylisocyanate
2,3-Dihydro-1,4-benzodioxin-6-yl-isocyanate
AC1MCQRQ
ACMC-1BV7L
SCHEMBL592019
