Home Other Building Blocks 1,2-difluoro-3-isocyanatobenzene

1,2-difluoro-3-isocyanatobenzene

CAS No.:
1174233-36-3
Catalog Number:
AG01B1R4
Molecular Formula:
C7H3F2NO
Molecular Weight:
155.1016
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Product Description
Catalog Number:
AG01B1R4
Chemical Name:
1,2-difluoro-3-isocyanatobenzene
CAS Number:
1174233-36-3
Molecular Formula:
C7H3F2NO
Molecular Weight:
155.1016
MDL Number:
MFCD16836280
IUPAC Name:
1,2-difluoro-3-isocyanatobenzene
InChI:
InChI=1S/C7H3F2NO/c8-5-2-1-3-6(7(5)9)10-4-11/h1-3H
InChI Key:
GSYUYIOROOKTAN-UHFFFAOYSA-N
SMILES:
Fc1c(cccc1F)N=C=O
Properties
Complexity:
179  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
155.018g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
155.104g/mol
Monoisotopic Mass:
155.018g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
29.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  
Properties