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Home > Aldehydes > 875570-95-9
875570-95-9 | 3-METHOXY-1-METHYL-1H-PYRAZOLE-4-CARBALDEHYDE
CAS No: 875570-95-9 Catalog No: AG01DWRI MDL No:MFCD24684869
Product Description
Catalog Number:
AG01DWRI
Chemical Name:
3-METHOXY-1-METHYL-1H-PYRAZOLE-4-CARBALDEHYDE
CAS Number:
875570-95-9
Molecular Formula:
C6H8N2O2
Molecular Weight:
140.1399
MDL Number:
MFCD24684869
IUPAC Name:
3-methoxy-1-methylpyrazole-4-carbaldehyde
InChI:
InChI=1S/C6H8N2O2/c1-8-3-5(4-9)6(7-8)10-2/h3-4H,1-2H3
InChI Key:
QIDULJWOAIZUJH-UHFFFAOYSA-N
SMILES:
COc1nn(cc1C=O)C
Properties
Complexity:
129
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
140.059g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
140.142g/mol
Monoisotopic Mass:
140.059g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
44.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0
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