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Home > Aldehydes > 824961-53-7
824961-53-7 | 5-(4-CHLOROPHENYL)-1-METHYL-1H-PYRROLE-2-CARBALDEHYDE
CAS No: 824961-53-7 Catalog No: AG008J7M MDL No:MFCD06438899
Product Description
Catalog Number:
AG008J7M
Chemical Name:
5-(4-CHLOROPHENYL)-1-METHYL-1H-PYRROLE-2-CARBALDEHYDE
CAS Number:
824961-53-7
Molecular Formula:
C12H10ClNO
Molecular Weight:
219.6669
MDL Number:
MFCD06438899
IUPAC Name:
5-(4-chlorophenyl)-1-methylpyrrole-2-carbaldehyde
InChI:
InChI=1S/C12H10ClNO/c1-14-11(8-15)6-7-12(14)9-2-4-10(13)5-3-9/h2-8H,1H3
InChI Key:
DAQYSXUEFNMIPO-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(n1C)c1ccc(cc1)Cl
Properties
Complexity:
226
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
219.045g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
219.668g/mol
Monoisotopic Mass:
219.045g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
22A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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