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Home > Aldehydes > 1392274-32-6
1392274-32-6 | 1-(1-ETHOXYETHYL)-1H-PYRAZOLE-5-CARBALDEHYDE
CAS No: 1392274-32-6 Catalog No: AG01AOP5 MDL No:MFCD24540502
Product Description
Catalog Number:
AG01AOP5
Chemical Name:
1-(1-ETHOXYETHYL)-1H-PYRAZOLE-5-CARBALDEHYDE
CAS Number:
1392274-32-6
Molecular Formula:
C8H12N2O2
Molecular Weight:
168.1931
MDL Number:
MFCD24540502
IUPAC Name:
2-(1-ethoxyethyl)pyrazole-3-carbaldehyde
InChI:
InChI=1S/C8H12N2O2/c1-3-12-7(2)10-8(6-11)4-5-9-10/h4-7H,3H2,1-2H3
InChI Key:
RGRZSQDKSBLNIT-UHFFFAOYSA-N
SMILES:
CCOC(n1nccc1C=O)C
Properties
Complexity:
152
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
168.09g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
168.196g/mol
Monoisotopic Mass:
168.09g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
44.1A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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