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Home > Aldehydes > 2090728-88-2
2090728-88-2 | 1-(propan-2-yl)-1H-pyrrole-2,5-dicarbaldehyde
CAS No: 2090728-88-2 Catalog No: AG01BTB7 MDL No:
Product Description
Catalog Number:
AG01BTB7
Chemical Name:
1-(propan-2-yl)-1H-pyrrole-2,5-dicarbaldehyde
CAS Number:
2090728-88-2
Molecular Formula:
C9H11NO2
Molecular Weight:
165.1891
IUPAC Name:
1-propan-2-ylpyrrole-2,5-dicarbaldehyde
InChI:
InChI=1S/C9H11NO2/c1-7(2)10-8(5-11)3-4-9(10)6-12/h3-7H,1-2H3
InChI Key:
YTVRLZPLZVZTBS-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(n1C(C)C)C=O
Properties
Complexity:
163
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
165.079g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
165.192g/mol
Monoisotopic Mass:
165.079g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
39.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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