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Home > Aldehydes > 1214384-89-0
1214384-89-0 | Benzaldehyde, 3-methoxy-2-(trifluoromethyl)-
CAS No: 1214384-89-0 Catalog No: AG0014YI MDL No:MFCD13185677
Product Description
Catalog Number:
AG0014YI
Chemical Name:
Benzaldehyde, 3-methoxy-2-(trifluoromethyl)-
CAS Number:
1214384-89-0
Molecular Formula:
C9H7F3O2
Molecular Weight:
204.1459
MDL Number:
MFCD13185677
IUPAC Name:
3-methoxy-2-(trifluoromethyl)benzaldehyde
InChI:
InChI=1S/C9H7F3O2/c1-14-7-4-2-3-6(5-13)8(7)9(10,11)12/h2-5H,1H3
InChI Key:
HSPNVFXNJYKWSK-UHFFFAOYSA-N
SMILES:
COc1cccc(c1C(F)(F)F)C=O
Properties
Complexity:
203
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
204.04g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
204.148g/mol
Monoisotopic Mass:
204.04g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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