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Home > Aldehydes > 858275-30-6
858275-30-6 | 1H-Pyrrolo[2,3-b]pyridine-3-carboxaldehyde,2-methyl-
CAS No: 858275-30-6 Catalog No: AG008GFM MDL No:MFCD11616737
Product Description
Catalog Number:
AG008GFM
Chemical Name:
1H-Pyrrolo[2,3-b]pyridine-3-carboxaldehyde,2-methyl-
CAS Number:
858275-30-6
Molecular Formula:
C9H10N2O
Molecular Weight:
162.1885
MDL Number:
MFCD11616737
IUPAC Name:
2-methyl-1H-pyrrolo[2,3-b]pyridine-3-carbaldehyde
InChI:
InChI=1S/C9H8N2O/c1-6-8(5-12)7-3-2-4-10-9(7)11-6/h2-5H,1H3,(H,10,11)
InChI Key:
DXESDXYYNGHALB-UHFFFAOYSA-N
SMILES:
O=Cc1c(C)[nH]c2=NCCC=c12
Properties
Complexity:
183
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:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
160.176g/mol
Monoisotopic Mass:
160.064g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
45.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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