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Home Other Building Blocks 3H-Diazirine, 3-(3-methoxyphenyl)-3-(trifluoromethyl)-

3H-Diazirine, 3-(3-methoxyphenyl)-3-(trifluoromethyl)-

CAS No.:
205485-24-1
Catalog Number:
AG002A3M
Molecular Formula:
C9H7F3N2O
Molecular Weight:
216.1599
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Product Description
Catalog Number:
AG002A3M
Chemical Name:
3H-Diazirine, 3-(3-methoxyphenyl)-3-(trifluoromethyl)-
CAS Number:
205485-24-1
Molecular Formula:
C9H7F3N2O
Molecular Weight:
216.1599
MDL Number:
MFCD07369489
IUPAC Name:
3-(3-methoxyphenyl)-3-(trifluoromethyl)diazirine
InChI:
InChI=1S/C9H7F3N2O/c1-15-7-4-2-3-6(5-7)8(13-14-8)9(10,11)12/h2-5H,1H3
InChI Key:
UKSNCZYTAMEFBK-UHFFFAOYSA-N
SMILES:
COc1cccc(c1)C1(N=N1)C(F)(F)F
Properties
Complexity:
271  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
216.051g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
216.163g/mol
Monoisotopic Mass:
216.051g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
34A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  
Literature
Title Journal
Diazirine-modified gold nanoparticle: template for efficient photoinduced interfacial carbene insertion reactions. Langmuir : the ACS journal of surfaces and colloids 20100921
Effective synthesis of optically active trifluoromethyldiazirinyl homophenylalanine and aroylalanine derivatives with the Friedel-Crafts reaction in triflic acid. Bioscience, biotechnology, and biochemistry 20090601
Properties