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Home > Aldehydes > 199192-04-6
199192-04-6 | 1H-Imidazole-4-carboxaldehyde, 1-propyl-
CAS No: 199192-04-6 Catalog No: AG002BYJ MDL No:MFCD06797720
Product Description
Catalog Number:
AG002BYJ
Chemical Name:
1H-Imidazole-4-carboxaldehyde, 1-propyl-
CAS Number:
199192-04-6
Molecular Formula:
C7H10N2O
Molecular Weight:
138.1671
MDL Number:
MFCD06797720
IUPAC Name:
1-propylimidazole-4-carbaldehyde
InChI:
InChI=1S/C7H10N2O/c1-2-3-9-4-7(5-10)8-6-9/h4-6H,2-3H2,1H3
InChI Key:
VLWJUYLXFWFDSW-UHFFFAOYSA-N
SMILES:
CCCn1cnc(c1)C=O
Properties
Complexity:
116
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
138.079g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
138.17g/mol
Monoisotopic Mass:
138.079g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
34.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
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