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Home > Aldehydes > 885278-12-6
885278-12-6 | 2-Propoxynicotinaldehyde
CAS No: 885278-12-6 Catalog No: AG0047AW MDL No:MFCD06804561
Product Description
Catalog Number:
AG0047AW
Chemical Name:
2-Propoxynicotinaldehyde
CAS Number:
885278-12-6
Molecular Formula:
C9H11NO2
Molecular Weight:
165.1891
MDL Number:
MFCD06804561
IUPAC Name:
2-propoxypyridine-3-carbaldehyde
InChI:
InChI=1S/C9H11NO2/c1-2-6-12-9-8(7-11)4-3-5-10-9/h3-5,7H,2,6H2,1H3
InChI Key:
CBTKKULPWZVYOL-UHFFFAOYSA-N
SMILES:
CCCOc1ncccc1C=O
Properties
Complexity:
139
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:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
165.192g/mol
Monoisotopic Mass:
165.079g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
39.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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