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Home Other Building Blocks Benzene, 1-isocyanato-3-methoxy-

Benzene, 1-isocyanato-3-methoxy-

CAS No.:
18908-07-1
Catalog Number:
AG002HUC
Molecular Formula:
C8H7NO2
Molecular Weight:
149.1467
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
99%
In Stock USA
United States
$111
- +
5g
99%
In Stock USA
United States
$148
- +
25g
99%
In Stock USA
United States
$293
- +
Product Description
Catalog Number:
AG002HUC
Chemical Name:
Benzene, 1-isocyanato-3-methoxy-
CAS Number:
18908-07-1
Molecular Formula:
C8H7NO2
Molecular Weight:
149.1467
MDL Number:
MFCD00002019
IUPAC Name:
1-isocyanato-3-methoxybenzene
InChI:
InChI=1S/C8H7NO2/c1-11-8-4-2-3-7(5-8)9-6-10/h2-5H,1H3
InChI Key:
NPOVTGVGOBJZPY-UHFFFAOYSA-N
SMILES:
O=C=Nc1cccc(c1)OC
EC Number:
242-658-3
Properties
Complexity:
164  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
149.048g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
149.149g/mol
Monoisotopic Mass:
149.048g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
38.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1  
Literature
Title Journal
Hydroxybenzothiazoles as new nonsteroidal inhibitors of 17β-hydroxysteroid dehydrogenase type 1 (17β-HSD1). PloS one 20120101
Solid phase microextraction: measurement of volatile organic compounds (VOCs) in Dhaka City air pollution. Journal of environmental science and health. Part A, Toxic/hazardous substances & environmental engineering 20020801
Properties