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Home > Aldehydes > 124678-35-9
124678-35-9 | 1H-Pyrrole-3-carboxaldehyde, 1-(2-methoxyphenyl)-2,5-dimethyl-
CAS No: 124678-35-9 Catalog No: AG000MLM MDL No:MFCD02904624
Product Description
Catalog Number:
AG000MLM
Chemical Name:
1H-Pyrrole-3-carboxaldehyde, 1-(2-methoxyphenyl)-2,5-dimethyl-
CAS Number:
124678-35-9
Molecular Formula:
C14H15NO2
Molecular Weight:
229.2744
MDL Number:
MFCD02904624
IUPAC Name:
1-(2-methoxyphenyl)-2,5-dimethylpyrrole-3-carbaldehyde
InChI:
InChI=1S/C14H15NO2/c1-10-8-12(9-16)11(2)15(10)13-6-4-5-7-14(13)17-3/h4-9H,1-3H3
InChI Key:
LJUKIOLDWAYBCI-UHFFFAOYSA-N
SMILES:
O=Cc1cc(n(c1C)c1ccccc1OC)C
Properties
Complexity:
269
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
229.11g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
229.279g/mol
Monoisotopic Mass:
229.11g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
31.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
Literature
| Title | Journal |
|---|---|
| Microsphere-based protease assays and screening application for lethal factor and factor Xa. | Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501 |
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