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261952-22-1

261952-22-1 | Benzene, 1-methoxy-2-(trifluoromethoxy)-

CAS No: 261952-22-1 Catalog No: AG002S70 MDL No:MFCD01631503

Product Description

Catalog Number:
AG002S70
Chemical Name:
Benzene, 1-methoxy-2-(trifluoromethoxy)-
CAS Number:
261952-22-1
Molecular Formula:
C8H7F3O2
Molecular Weight:
192.1352
MDL Number:
MFCD01631503
IUPAC Name:
1-methoxy-2-(trifluoromethoxy)benzene
InChI:
InChI=1S/C8H7F3O2/c1-12-6-4-2-3-5-7(6)13-8(9,10)11/h2-5H,1H3
InChI Key:
TUXDRFWDZPJPPD-UHFFFAOYSA-N
SMILES:
COc1ccccc1OC(F)(F)F

Properties

Complexity:
158  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
192.04g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
192.137g/mol
Monoisotopic Mass:
192.04g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  

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