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1003048-68-7

1003048-68-7 | 1H-Inden-1-one, 2,3-dihydro-7-(trifluoromethyl)-

CAS No: 1003048-68-7 Catalog No: AG0001K6 MDL No:MFCD11040251

Product Description

Catalog Number:
AG0001K6
Chemical Name:
1H-Inden-1-one, 2,3-dihydro-7-(trifluoromethyl)-
CAS Number:
1003048-68-7
Molecular Formula:
C10H7F3O
Molecular Weight:
200.1572
MDL Number:
MFCD11040251
IUPAC Name:
7-(trifluoromethyl)-2,3-dihydroinden-1-one
InChI:
InChI=1S/C10H7F3O/c11-10(12,13)7-3-1-2-6-4-5-8(14)9(6)7/h1-3H,4-5H2
InChI Key:
RHHGHWBHOQXKNZ-UHFFFAOYSA-N
SMILES:
O=C1CCc2c1c(ccc2)C(F)(F)F

Properties

Complexity:
246  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
200.045g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
200.16g/mol
Monoisotopic Mass:
200.045g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  

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