Home Aldehydes 1-(2,4-dimethylphenyl)-2,5-dimethyl-pyrrole-3-carbaldehyde

1-(2,4-dimethylphenyl)-2,5-dimethyl-pyrrole-3-carbaldehyde

CAS No.:
328028-87-1
Catalog Number:
AG00I69K
Molecular Formula:
C15H17NO
Molecular Weight:
227.3016
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Product Description
Catalog Number:
AG00I69K
Chemical Name:
1-(2,4-dimethylphenyl)-2,5-dimethyl-pyrrole-3-carbaldehyde
CAS Number:
328028-87-1
Molecular Formula:
C15H17NO
Molecular Weight:
227.3016
MDL Number:
MFCD02605180
IUPAC Name:
1-(2,4-dimethylphenyl)-2,5-dimethylpyrrole-3-carbaldehyde
InChI:
InChI=1S/C15H17NO/c1-10-5-6-15(11(2)7-10)16-12(3)8-14(9-17)13(16)4/h5-9H,1-4H3
InChI Key:
CPJASJOAHPXUCS-UHFFFAOYSA-N
SMILES:
O=Cc1cc(n(c1C)c1ccc(cc1C)C)C
Properties
Complexity:
278  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
227.131g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
227.307g/mol
Monoisotopic Mass:
227.131g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
22A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3  
Properties