200,000+ products from a single source!
sales@angenechem.com
821799-28-4 | 3-Hexen-2-ol, 6-phenyl-4-(trifluoromethyl)-, acetate, (2R,3E)-
CAS No: 821799-28-4 Catalog No: AG005I1I MDL No:
Product Description
Catalog Number:
AG005I1I
Chemical Name:
3-Hexen-2-ol, 6-phenyl-4-(trifluoromethyl)-, acetate, (2R,3E)-
CAS Number:
821799-28-4
Molecular Formula:
C15H19F3O3
Molecular Weight:
304.3048
IUPAC Name:
acetic acid;(2R)-6-phenyl-4-(trifluoromethyl)hex-3-en-2-ol
InChI:
InChI=1S/C13H15F3O.C2H4O2/c1-10(17)9-12(13(14,15)16)8-7-11-5-3-2-4-6-11;1-2(3)4/h2-6,9-10,17H,7-8H2,1H3;1H3,(H,3,4)/t10-;/m1./s1
InChI Key:
BQFKQIZDKIEZFP-HNCPQSOCSA-N
SMILES:
C[C@H](/C=C(/C(F)(F)F)\CCc1ccccc1)O.CC(=O)O
Properties
Complexity:
283
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
304.129g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
304.309g/mol
Monoisotopic Mass:
304.129g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
57.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.