Home Aldehydes 3-Methyl-1H-pyrrole-2-carbaldehyde

3-Methyl-1H-pyrrole-2-carbaldehyde

CAS No.:
24014-18-4
Catalog Number:
AG007OAH
Molecular Formula:
C6H7NO
Molecular Weight:
109.1259
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Product Description
Catalog Number:
AG007OAH
Chemical Name:
3-Methyl-1H-pyrrole-2-carbaldehyde
CAS Number:
24014-18-4
Molecular Formula:
C6H7NO
Molecular Weight:
109.1259
MDL Number:
MFCD00030343
IUPAC Name:
3-methyl-1H-pyrrole-2-carbaldehyde
InChI:
InChI=1S/C6H7NO/c1-5-2-3-7-6(5)4-8/h2-4,7H,1H3
InChI Key:
WBMRBLKBBVYQSD-UHFFFAOYSA-N
SMILES:
O=Cc1[nH]ccc1C
Properties
Complexity:
92.5  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
109.053g/mol
Formal Charge:
0
Heavy Atom Count:
8  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
109.128g/mol
Monoisotopic Mass:
109.053g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
32.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9  
Properties