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1431329-82-6

1431329-82-6 | 4-Methoxy-3-methyl-5-(trifluoromethyl)benzyl alcohol

CAS No: 1431329-82-6 Catalog No: AG01F8JA MDL No:

Product Description

Catalog Number:
AG01F8JA
Chemical Name:
4-Methoxy-3-methyl-5-(trifluoromethyl)benzyl alcohol
CAS Number:
1431329-82-6
Molecular Formula:
C10H11F3O2
Molecular Weight:
220.1883
IUPAC Name:
[4-methoxy-3-methyl-5-(trifluoromethyl)phenyl]methanol
InChI:
InChI=1S/C10H11F3O2/c1-6-3-7(5-14)4-8(9(6)15-2)10(11,12)13/h3-4,14H,5H2,1-2H3
InChI Key:
IXDIHSCLYNBPML-UHFFFAOYSA-N
SMILES:
COc1c(C)cc(cc1C(F)(F)F)CO

Properties

Complexity:
205  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
220.071g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
220.191g/mol
Monoisotopic Mass:
220.071g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  

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