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Home > Aldehydes > 220371-24-4
220371-24-4 | [2,2'-Bi-1H-pyrrole]-4-carboxaldehyde
CAS No: 220371-24-4 Catalog No: AG0070SZ MDL No:
Product Description
Catalog Number:
AG0070SZ
Chemical Name:
[2,2'-Bi-1H-pyrrole]-4-carboxaldehyde
CAS Number:
220371-24-4
Molecular Formula:
C9H8N2O
Molecular Weight:
160.1726
IUPAC Name:
5-(1H-pyrrol-2-yl)-1H-pyrrole-3-carbaldehyde
InChI:
InChI=1S/C9H8N2O/c12-6-7-4-9(11-5-7)8-2-1-3-10-8/h1-6,10-11H
InChI Key:
QIANXWZQRAOBNF-UHFFFAOYSA-N
SMILES:
O=Cc1c[nH]c(c1)c1ccc[nH]1
Properties
Complexity:
172
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
160.064g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
160.176g/mol
Monoisotopic Mass:
160.064g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
48.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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