Home Other Building Blocks 1-Chloro-2-fluoro-3-isocyanatobenzene

1-Chloro-2-fluoro-3-isocyanatobenzene

CAS No.:
69922-25-4
Catalog Number:
AG003E7I
Molecular Formula:
C7H3ClFNO
Molecular Weight:
171.5562
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
97%
In Stock USA
United States
$37
- +
5g
97%
In Stock USA
United States
$118
- +
25g
97%
In Stock USA
United States
$475
- +
Product Description
Catalog Number:
AG003E7I
Chemical Name:
1-Chloro-2-fluoro-3-isocyanatobenzene
CAS Number:
69922-25-4
Molecular Formula:
C7H3ClFNO
Molecular Weight:
171.5562
MDL Number:
MFCD03701597
IUPAC Name:
1-chloro-2-fluoro-3-isocyanatobenzene
InChI:
InChI=1S/C7H3ClFNO/c8-5-2-1-3-6(7(5)9)10-4-11/h1-3H
InChI Key:
SPMPFFGBFMAFOO-UHFFFAOYSA-N
SMILES:
Fc1c(cccc1Cl)N=C=O
Properties
Complexity:
181  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
170.989g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
171.555g/mol
Monoisotopic Mass:
170.989g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
29.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5  
Properties