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Home > Aldehydes > 1909319-79-4
1909319-79-4 | 6-bromo-3,4-difluoro-2-(piperidin-1-yl)benzaldehyde
CAS No: 1909319-79-4 Catalog No: AG01C50E MDL No:MFCD29763258
Product Description
Catalog Number:
AG01C50E
Chemical Name:
6-bromo-3,4-difluoro-2-(piperidin-1-yl)benzaldehyde
CAS Number:
1909319-79-4
Molecular Formula:
C12H12BrF2NO
Molecular Weight:
304.1306
MDL Number:
MFCD29763258
IUPAC Name:
6-bromo-3,4-difluoro-2-piperidin-1-ylbenzaldehyde
InChI:
InChI=1S/C12H12BrF2NO/c13-9-6-10(14)11(15)12(8(9)7-17)16-4-2-1-3-5-16/h6-7H,1-5H2
InChI Key:
WSRYIQFBFYYSCN-UHFFFAOYSA-N
SMILES:
O=Cc1c(Br)cc(c(c1N1CCCCC1)F)F
Properties
Complexity:
273
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
303.007g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
304.135g/mol
Monoisotopic Mass:
303.007g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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