Home Other Building Blocks 4-fluorobenzyl carbonochloridate

4-fluorobenzyl carbonochloridate

CAS No.:
105416-91-9
Catalog Number:
AG01BK87
Molecular Formula:
C8H6ClFO2
Molecular Weight:
188.5834
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Product Description
Catalog Number:
AG01BK87
Chemical Name:
4-fluorobenzyl carbonochloridate
CAS Number:
105416-91-9
Molecular Formula:
C8H6ClFO2
Molecular Weight:
188.5834
MDL Number:
MFCD25954943
IUPAC Name:
(4-fluorophenyl)methyl carbonochloridate
InChI:
InChI=1S/C8H6ClFO2/c9-8(11)12-5-6-1-3-7(10)4-2-6/h1-4H,5H2
InChI Key:
CNDKJCOMEMJVKI-UHFFFAOYSA-N
SMILES:
ClC(=O)OCc1ccc(cc1)F
Properties
Complexity:
155  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
188.004g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
188.582g/mol
Monoisotopic Mass:
188.004g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3  
Properties