Home Other Building Blocks 1-methyl-3-(trifluoromethyl)cyclohexan-1-ol

1-methyl-3-(trifluoromethyl)cyclohexan-1-ol

CAS No.:
1343325-22-3
Catalog Number:
AG01BB3M
Molecular Formula:
C8H13F3O
Molecular Weight:
182.1834
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Product Description
Catalog Number:
AG01BB3M
Chemical Name:
1-methyl-3-(trifluoromethyl)cyclohexan-1-ol
CAS Number:
1343325-22-3
Molecular Formula:
C8H13F3O
Molecular Weight:
182.1834
MDL Number:
MFCD20410426
IUPAC Name:
1-methyl-3-(trifluoromethyl)cyclohexan-1-ol
InChI:
InChI=1S/C8H13F3O/c1-7(12)4-2-3-6(5-7)8(9,10)11/h6,12H,2-5H2,1H3
InChI Key:
JMPWQCUTPMHHRL-UHFFFAOYSA-N
SMILES:
CC1(O)CCCC(C1)C(F)(F)F
Properties
Complexity:
166  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
182.092g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
182.186g/mol
Monoisotopic Mass:
182.092g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  
Properties