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Home > Aldehydes > 876322-73-5
876322-73-5 | 4-Amino-2-(trifluoromethyl)benzaldehyde
CAS No: 876322-73-5 Catalog No: AG0039NN MDL No:MFCD04973746
Product Description
Catalog Number:
AG0039NN
Chemical Name:
4-Amino-2-(trifluoromethyl)benzaldehyde
CAS Number:
876322-73-5
Molecular Formula:
C8H6F3NO
Molecular Weight:
189.1345
MDL Number:
MFCD04973746
IUPAC Name:
4-amino-2-(trifluoromethyl)benzaldehyde
InChI:
InChI=1S/C8H6F3NO/c9-8(10,11)7-3-6(12)2-1-5(7)4-13/h1-4H,12H2
InChI Key:
GAVVLGXVZCHXCC-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(cc1C(F)(F)F)N
Properties
Complexity:
192
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
189.04g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
189.137g/mol
Monoisotopic Mass:
189.04g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
43.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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