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87282-19-7 | 3H-Diazirine, 3-fluoro-3-phenyl-
CAS No: 87282-19-7 Catalog No: AG004PEI MDL No:
Product Description
Catalog Number:
AG004PEI
Chemical Name:
3H-Diazirine, 3-fluoro-3-phenyl-
CAS Number:
87282-19-7
Molecular Formula:
C7H5FN2
Molecular Weight:
136.1264
IUPAC Name:
3-fluoro-3-phenyldiazirine
InChI:
InChI=1S/C7H5FN2/c8-7(9-10-7)6-4-2-1-3-5-6/h1-5H
InChI Key:
VCLRTAHJYAXLEJ-UHFFFAOYSA-N
SMILES:
FC1(N=N1)c1ccccc1
Properties
Complexity:
155
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
136.044g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
136.129g/mol
Monoisotopic Mass:
136.044g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
24.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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