Home Other Building Blocks 2-{[2-(trifluoromethyl)phenyl]methyl}oxirane

2-{[2-(trifluoromethyl)phenyl]methyl}oxirane

CAS No.:
62826-31-7
Catalog Number:
AG01A1X1
Molecular Formula:
C10H9F3O
Molecular Weight:
202.1731
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Product Description
Catalog Number:
AG01A1X1
Chemical Name:
2-{[2-(trifluoromethyl)phenyl]methyl}oxirane
CAS Number:
62826-31-7
Molecular Formula:
C10H9F3O
Molecular Weight:
202.1731
MDL Number:
MFCD22565976
IUPAC Name:
2-[[2-(trifluoromethyl)phenyl]methyl]oxirane
InChI:
InChI=1S/C10H9F3O/c11-10(12,13)9-4-2-1-3-7(9)5-8-6-14-8/h1-4,8H,5-6H2
InChI Key:
MMFCMICIKUOWGM-UHFFFAOYSA-N
SMILES:
FC(c1ccccc1CC1CO1)(F)F
Properties
Complexity:
202  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
202.061g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
202.176g/mol
Monoisotopic Mass:
202.061g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
12.5A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  
Properties