Home Aldehydes 1-(difluoromethyl)-1H-pyrrole-2-carbaldehyde

1-(difluoromethyl)-1H-pyrrole-2-carbaldehyde

CAS No.:
1519187-90-6
Catalog Number:
AG01BF83
Molecular Formula:
C6H5F2NO
Molecular Weight:
145.1068
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Product Description
Catalog Number:
AG01BF83
Chemical Name:
1-(difluoromethyl)-1H-pyrrole-2-carbaldehyde
CAS Number:
1519187-90-6
Molecular Formula:
C6H5F2NO
Molecular Weight:
145.1068
MDL Number:
MFCD21766137
IUPAC Name:
1-(difluoromethyl)pyrrole-2-carbaldehyde
InChI:
InChI=1S/C6H5F2NO/c7-6(8)9-3-1-2-5(9)4-10/h1-4,6H
InChI Key:
HEFWOSFNVTXCEX-UHFFFAOYSA-N
SMILES:
O=Cc1cccn1C(F)F
Properties
Complexity:
129  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
145.034g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
145.109g/mol
Monoisotopic Mass:
145.034g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
22A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  
Properties