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Home > Aldehydes > 861928-27-0
861928-27-0 | 4-Bromo-2-(trifluoromethyl);benzaldehyde
CAS No: 861928-27-0 Catalog No: AG003KVG MDL No:MFCD09037472
Product Description
Catalog Number:
AG003KVG
Chemical Name:
4-Bromo-2-(trifluoromethyl);benzaldehyde
CAS Number:
861928-27-0
Molecular Formula:
C8H4BrF3O
Molecular Weight:
253.0160
MDL Number:
MFCD09037472
IUPAC Name:
4-bromo-2-(trifluoromethyl)benzaldehyde
InChI:
InChI=1S/C8H4BrF3O/c9-6-2-1-5(4-13)7(3-6)8(10,11)12/h1-4H
InChI Key:
PROPHDFGNNBHJX-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(cc1C(F)(F)F)Br
Properties
Complexity:
192
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
251.94g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
253.018g/mol
Monoisotopic Mass:
251.94g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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