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Home > Aldehydes > 116967-16-9
116967-16-9 | 1H-Pyrrole-2-carboxaldehyde,1-(hydroxymethyl)-(9CI)
CAS No: 116967-16-9 Catalog No: AG009Q1W MDL No:
Product Description
Catalog Number:
AG009Q1W
Chemical Name:
1H-Pyrrole-2-carboxaldehyde,1-(hydroxymethyl)-(9CI)
CAS Number:
116967-16-9
IUPAC Name:
1-(hydroxymethyl)pyrrole-2-carbaldehyde
InChI:
InChI=1S/C6H7NO2/c8-4-6-2-1-3-7(6)5-9/h1-4,9H,5H2
InChI Key:
XGZAKLAGPQJGRO-UHFFFAOYSA-N
Properties
Complexity:
105
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
125.048g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
125.127g/mol
Monoisotopic Mass:
125.048g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
42.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.2
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