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2924-25-6 | Benzene, 1-(1-propen-1-yl)-3-(trifluoromethyl)-
CAS No: 2924-25-6 Catalog No: AG002XTS MDL No:
Product Description
Catalog Number:
AG002XTS
Chemical Name:
Benzene, 1-(1-propen-1-yl)-3-(trifluoromethyl)-
CAS Number:
2924-25-6
Molecular Formula:
C10H9F3
Molecular Weight:
186.1737
IUPAC Name:
1-[(E)-prop-1-enyl]-3-(trifluoromethyl)benzene
InChI:
InChI=1S/C10H9F3/c1-2-4-8-5-3-6-9(7-8)10(11,12)13/h2-7H,1H3/b4-2+
InChI Key:
OUZWHCIDWBRHFD-DUXPYHPUSA-N
SMILES:
CC=Cc1cccc(c1)C(F)(F)F
EC Number:
220-888-5
Properties
Complexity:
181
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
186.066g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
186.177g/mol
Monoisotopic Mass:
186.066g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8
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